Dimethylamine

Dimethylamine

SCHEMBL447538

CNC.Cc1c(C(=O)NCCOc2ccc(C(=O)NO)cc2)oc2ccccc12

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.71
HDAC2 Q92769 3/20 0.71
HDAC3 O15379 2/20 0.71
HDAC10 Q969S8 2/20 0.71
HDAC8 Q9BY41 2/20 0.71
HDAC6 Q9UBN7 2/20 0.71
HDAC4 P56524 1/20 0.71
HDAC7 Q8WUI4 1/20 0.71
HDAC11 Q96DB2 1/20 0.71
HDAC9 Q9UKV0 1/20 0.71
HDAC5 Q9UQL6 1/20 0.71
NCOR2 Q9Y618 1/20 0.71
NPC1 O15118 6/20 0.55
RAB9A P51151 4/20 0.55
RXFP1 Q9HBX9 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPK1 P28482 1/20 0.49
GPR55 Q9Y2T6 1/20 0.48
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Dimethylamine SCHEMBL14762288 0.99 HDAC1 (0.71) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL444587 0.98 HDAC1 (0.73) HDAC1HDAC2HDAC3HDAC10HDAC8
Diethylamine SCHEMBL445593 0.93 HDAC1 (0.67) HDAC1HDAC2HDAC3HDAC10HDAC8
Dimethylamine SCHEMBL15992082 0.90 HDAC1 (0.59) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL4247836 0.89 HDAC1 (0.61) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL443572 0.87 HDAC1 (0.59) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL18597368 0.86 HDAC3 (0.77) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL443222 0.85 HDAC3 (0.80) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL4257526 0.85 HDAC1 (0.57) HDAC1HDAC2HDAC3HDAC10HDAC8
SCHEMBL417658 0.85 HDAC3 (0.76) HDAC1HDAC2HDAC3HDAC10HDAC8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2964622-B1 NOVEL ABEXINOSTAT SALT, ASSOCIATED CRYSTALLINE FORM, PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME PHARMACYCLICS LLC (US) 2017-04-19 EP claimed
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2016-08-25 US claimed
EP-2753322-B1 DOSAGE REGIMEN OF N-HYDROXY-4-{2-[3-(N,N-DIMETHYLAMINOMETHYL)BENZOFURAN-2-YLCARBONYLAMINO]ETHOXY}BENZAMIDE PHARMACYCLICS INC (US) 2016-08-03 EP claimed
EP-2964622-A1 NOVEL ABEXINOSTATE SALT, ASSOCIATED CRYSTALLINE FORM, PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Pharmacyclics LLC (US) 2016-01-13 EP claimed
US-20150038513-A1 ASSOCIATION BETWEEN N-HYDROXY-4-BENZAMIDE AND FOLFOX PHARMACYCLICS LLC 2015-02-05 US claimed
US-20150024040-A1 ADMINISTRATION REGIME FOR N-HYDROXY-4-BENZAMIDE PHARMACYCLICS LLC 2015-01-22 US claimed
US-20140341989-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR IN COMBINATION WITH BENDAMUSTINE AND USES THEREOF LES LABORATOIRES SERVIER SAS (FR) 2014-11-20 US claimed
US-8883199-B2 Administration regime for N-hydroxy-4-{2-[3-(N,N-dimethylaminomethyl)benzofuran-2- ylcarbonylamino]ethoxy}benzamide LES LABORATOIRES SERVIER (FR) 2014-11-11 US claimed
WO-2014135776-A1 NOVEL ABEXINOSTATE SALT, ASSOCIATED CRYSTALLINE FORM, PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2014-09-12 WO claimed
EP-2755648-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR IN COMBINATION WITH BENDAMUSTINE AND USES THEREOF Pharmacyclics, Inc. (US) 2014-07-23 EP claimed
WO-2013093248-A1 NOVEL COMBINATIONS CONTAINING N-HYDROXY-4-(2-[3-(N, N-DIMETHYLAMINOMETHYL) BENZOFURAN-2-YLCARBONYLAMINO]ETHOXY)BENZAMIDE IN NASOPHARYNGEAL CARCINOMA LES LABORATOIRES SERVIER (FR) 2013-06-27 WO claimed
WO-2013039488-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR IN COMBINATION WITH BENDAMUSTINE AND USES THEREOF PHARMACYCLICS, INC. (US) 2013-03-21 WO claimed
US-20130064880-A1 ADMINISTRATION REGIME FOR N-HYDROXY-4-BENZAMIDE PHARMACYCLICS, INC. 2013-03-14 US claimed
US-20110311624-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR AND USES THEREOF PHARMACYCLICS, INC. (US) 2011-12-22 US claimed
US-20110021528-A1 NOVEL HYDROXAMATES AS THERAPEUTIC AGENTS PHARMACYCLICS, INC. (US) 2011-01-27 US claimed
EP-1611088-B1 HYDROXAMATES AS THERAPEUTIC AGENTS PHARMACYCLICS INC (US) 2009-06-17 EP claimed
US-7276612-B2 For hepatitis C; histone deacetylase inhibitors; N-hydroxy-4-{[(benzofuran-, benzothiophen-, or indol-)-2-ylcarbonylamino]alkoxy}benzamides PHARMACYCLICS, INC. (US) 2007-10-02 US claimed
US-20050187261-A1 For hepatitis C; histone deacetylase inhibitors, anticarcinogenic agents; N-hydroxy-4-{[(benzofuran-, benzothiophen-, or indol-)-2-ylcarbonylamino]alkoxy}benzamides; amidation of a benzoic acid, benzoate, benzoyl halide with hydroxyamine AXYS PHARMACEUTICALS, INC. (US) 2005-08-25 US claimed
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2020-07-02 US disclosed
WO-2004092115-A2 HYDROXAMATES AS THERAPEUTIC AGENTS AXYS PHARMACEUTICALS INC. (US) 2004-10-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110311624-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR AND USES THEREOF HDAC1, HDAC7, HDAC5 HDAC1 1/4885HDAC2 5/4885HDAC3 7/4885
US-20140341989-A1 FORMULATIONS OF HISTONE DEACETYLASE INHIBITOR IN COMBINATION WITH BENDAMUSTINE AND USES THEREOF HDAC5, HDAC7, HDAC4 HDAC1 7/4885HDAC2 8/4885HDAC3 11/4885
US-20130064880-A1 ADMINISTRATION REGIME FOR N-HYDROXY-4-BENZAMIDE FOLR2, SLC19A1, FOLR1 HDAC1 305/4885HDAC2 405/4885HDAC3 673/4885
US-20050187261-A1 For hepatitis C; histone deacetylase inhibitors, anticarcinogenic agents; N-hydroxy-4-{[(benzofuran-, benzothiophen-, or indol-)-2-ylcarbonylamino]alkoxy}benzamides; amidation of a benzoic acid, benzoate, benzoyl halide with hydroxyamine AADAC, HDAC3, HDAC4 HDAC1 5/4885HDAC2 10/4885HDAC3 2/4885
US-20110021528-A1 NOVEL HYDROXAMATES AS THERAPEUTIC AGENTS HDAC1, HDAC3, HDAC5 HDAC1 1/4885HDAC2 10/4885HDAC3 2/4885
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 HDAC1 1404/4885HDAC2 931/4885HDAC3 884/4885
US-20150038513-A1 ASSOCIATION BETWEEN N-HYDROXY-4-BENZAMIDE AND FOLFOX FOLR2, FOLR1, SLC10A2 HDAC1 344/4885HDAC2 349/4885HDAC3 394/4885
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 HDAC1 1404/4885HDAC2 931/4885HDAC3 884/4885
US-20150024040-A1 ADMINISTRATION REGIME FOR N-HYDROXY-4-BENZAMIDE FOLR2, SLC19A1, FOLR1 HDAC1 305/4885HDAC2 405/4885HDAC3 673/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.