SCHEMBL1748269

SCHEMBL1748269

O=Cc1cc(Cl)cc2c1OCO2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.44
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 1/20 0.39
GSK3B P49841 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAOB P27338 4/20 0.33
PTPN1 P18031 1/20 0.33
MAOA P21397 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
NQO2 P16083 1/20 0.31

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
SCHEMBL30902339 1.00 ERN1 (0.44) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL30933917 0.85 ERN1 (0.44) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL1748466 0.85 ERN1 (0.44) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL12553097 0.78 LMNA (0.46) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL6541735 0.78 LMNA (0.42) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL5271445 0.75 ALDH1A1 (0.35) LMNAHPGDTDP1ALDH1A1HSD17B10
SCHEMBL6002004 0.75 ERN1 (0.50) ERN1MAPTKMT2A
SCHEMBL11081166 0.74 AHR (0.47) ALDH1A1HSD17B10MAPTKMT2AMAOB
SCHEMBL11608654 0.74 TSHR (0.40) ERN1LMNAHPGDTDP1ALDH1A1
SCHEMBL15828709 0.74 LMNA (0.42) ERN1LMNAHPGDTDP1ALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604021-B2 Substituted arylamine compounds and methods of treatment BECKER OREN (IL) 2013-12-10 US disclosed
US-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 US disclosed
US-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 US disclosed
US-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT BECKER OREN (IL) 2012-05-10 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
US-7968538-B2 Substituted arylamine compounds and methods of treatment GALENEA CORP. (US) 2011-06-28 US disclosed
EP-1856075-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS Epix Delaware, Inc. (US) 2007-11-21 EP disclosed
US-20060205737-A1 Substituted arylamine compounds and methods of treatment GALENEA CORPORATION 2006-09-14 US disclosed
WO-2006081332-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS EPIX DELAWARE, INC. (US) 2006-08-03 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 (2 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-20120115850-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND METHODS OF TREATMENT HTR6, HTR2A, HTR3B ERN1 4404/4885LMNA 4313/4885HPGD 2326/4885
US-20060205737-A1 Substituted arylamine compounds and methods of treatment HTR6, HTR2A, HTR3B ERN1 4404/4885LMNA 4313/4885HPGD 2326/4885

“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.