SCHEMBL7730804

SCHEMBL7730804

CCNCCN1CCN(C)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.48
PRMT6 Q96LA8 3/20 0.45
KDM1A O60341 1/20 0.44
CARM1 Q86X55 2/20 0.39
PRMT8 Q9NR22 2/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CYP2C19 P33261 2/20 0.36
MEN1 O00255 1/20 0.36
GLA P06280 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR1 P21554 1/20 0.36
PGK1 P00558 2/20 0.35
PAOX Q6QHF9 1/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35
PRMT1 Q99873 1/20 0.34

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
SCHEMBL21367124 0.96 ACE2 (0.50) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL4783223 0.93 ACE2 (0.54) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL13660816 0.92 PRMT6 (0.43) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL19071988 0.88 ACE2 (0.56) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL4395015 0.87 ACE2 (0.61) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL22416471 0.86 ACE2 (0.40) ACE2PRMT6KDM1ACARM1PRMT8
SCHEMBL10099919 0.86 CYP2C19 (0.44) ACE2KDM1ACYP2C19MEN1GLA
SCHEMBL10282545 0.86 ACE2 (0.48) ACE2PRMT6CARM1PRMT8CYP2C19
SCHEMBL14479170 0.85 CYP2C19 (0.46) ACE2KDM1ACYP2C19MEN1GLA
SCHEMBL25737704 0.84 PRMT6 (0.60) ACE2PRMT6CARM1PRMT8PRMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE50030-E1 Methods to treat lymphoplasmacytic lymphoma DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-07-02 US disclosed
US-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ABM THERAPEUTICS CORP (US) 2023-09-28 US disclosed
EP-4105207-A1 QUINOLYL PHOSPHINE OXIDE COMPOUND, AND COMPOSITION AND APPLICATION THEREOF Betta Pharmaceuticals Co., Ltd (CN) 2022-12-21 EP disclosed
US-20220389019-A1 TrkB POSITIVE ALLOSTERIC MODULATORS INSERM - INSTITUT NATIONAL DE LA SANTÉ ET DE LA RECHERCHE MÉDICALE (FR) 2022-12-08 US disclosed
WO-2022093817-A1 MACROPHAGE MIGRATION INHIBITORY FACTOR INHIBITORS, AND METHODS OF MAKING AND USING SAME YALE UNIVERSITY (US) 2022-05-05 WO disclosed
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor YALE UNIVERSITY (US) 2021-04-06 US disclosed
EP-3267794-B1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR UNIV YALE (US) 2020-09-09 EP disclosed
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR UNIV YALE (US) 2019-09-12 US disclosed
US-20190209690-A9 Bioreducible Poly (Beta-Amino Ester)s For siRNA Delivery THE JOHNS HOPKINS UNIVERSITY (US) 2019-07-11 US disclosed
US-10336721-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor YALE UNIVERSITY (US) 2019-07-02 US disclosed
US-20080280889-A1 Inhibitors of Akt Activity MERCK SHARP & DOHME CORP. 2008-11-13 US disclosed
US-7429574-B2 4-heterocyclo-pyrrolo[2,3d] pyrimidine compositions and their use OSI PHARMACEUTICALS, INC. (US) 2008-09-30 US disclosed
US-20080070936-A1 Compounds specific to adenosine A1 receptors and uses thereof OSI PHARMACEUTICALS, INC. 2008-03-20 US disclosed
EP-1740574-B1 4-AMINO-5-CYANOPYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2007-06-27 EP disclosed
US-7160890-B2 Compounds specific to adenosine A3 receptor and uses thereof OSI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-6680324-B2 4-AMINO-6-PHENYL-PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2004-01-20 US disclosed
US-6346205-B2 Rigid polyurethane foams HUNTSMAN INTERNATIONAL LLC 2002-02-12 US disclosed
US-20010006986-A1 Rigid polyurethane foams IMPERIAL CHEMICAL INDUSTRIES PLC 2001-07-05 US disclosed
EP-0935625-B1 RIGID POLYURETHANE FOAMS HUNTSMAN INT LLC (US) 2001-06-27 EP disclosed
US-6207725-B1 REACTING ORGANIC POLYISOCYANATE WITH POLYESTERPOLYOL IN PRESENCE OF BLOWING AGNET AND CATALYST SELECTED FROM 2,2'-DIMORPHOLINODIETHYLETHER, 1-METHYLIMIDAZOLE, AND 4-DIMETHYLAMINOPYRIDINE AND SECOND TERTIARY AMINE CATALYST IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2001-03-27 US 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 (8 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-20230303570-A1 KINASE INHIBITORS AND USES THEREOF ERBB2, ERBB3, ERBB4 ACE2 1797/4885PRMT6 641/4885KDM1A 1993/4885
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor MIF, MMP12, CSF1R ACE2 2117/4885PRMT6 1317/4885KDM1A 3944/4885
US-20190209690-A9 Bioreducible Poly (Beta-Amino Ester)s For siRNA Delivery AARS1, SLC43A1, PHAX ACE2 1118/4885PRMT6 1756/4885KDM1A 3501/4885
US-10336721-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor MIF, MMP12, CSF1R ACE2 2117/4885PRMT6 1317/4885KDM1A 3944/4885
US-20080070936-A1 Compounds specific to adenosine A1 receptors and uses thereof ADORA1, ADORA2A, ADORA3 ACE2 1980/4885PRMT6 2203/4885KDM1A 2676/4885
US-20220389019-A1 TrkB POSITIVE ALLOSTERIC MODULATORS HTT, NTRK2, BDNF ACE2 4448/4885PRMT6 3271/4885KDM1A 1899/4885
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR MIF, MMP12, CSF1R ACE2 2117/4885PRMT6 1317/4885KDM1A 3944/4885
US-20080280889-A1 Inhibitors of Akt Activity AKT2, PIK3CA, AKT1 ACE2 2608/4885PRMT6 918/4885KDM1A 2194/4885

“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.