SCHEMBL1031223

SCHEMBL1031223

CN(C=O)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.48
ALDH5A1 P51649 1/20 0.42
ABAT P80404 1/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
TLR9 Q9NR96 1/20 0.41
ALDH1A1 P00352 6/20 0.38
MAPT P10636 5/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
KDM4E B2RXH2 4/20 0.38
ALOX15 P16050 4/20 0.38
HIF1A Q16665 4/20 0.38
HSD17B10 Q99714 4/20 0.38
HPGD P15428 4/20 0.38
NFKB1 P19838 3/20 0.38
RECQL P46063 3/20 0.38
BLM P54132 3/20 0.38
LMNA P02545 3/20 0.38
NPC1 O15118 3/20 0.38

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
Hydroquinone SCHEMBL1685813 0.79 TSHR (0.53) APPALDH5A1ABATALDH1A1MAPT
SCHEMBL1031222 0.78 CYP2A6 (0.39) ALDH1A1MAPTMEN1KMT2AALOX15
SCHEMBL2091673 0.78 ALDH1A1 (0.52) TLR9ALDH1A1MAPTMEN1KMT2A
SCHEMBL2090725 0.76 MAPT (0.40) TLR9ALDH1A1MAPTMEN1KMT2A
SCHEMBL203434 0.76 CYP2A6 (0.38) ALDH1A1ALOX15HSD17B10CYP2A6CYP2A13
SCHEMBL2099516 0.76 APP (0.48) APPALDH1A1MAPTALOX15HSD17B10
SCHEMBL9512083 0.76 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL2096460 0.76 ALDH1A1 (0.45) ALDH1A1MAPTKMT2AKDM4EALOX15
SCHEMBL14390627 0.76 APP (0.48) APPALDH5A1ABATCRHBPCRHR2
SCHEMBL11098248 0.76 CYP2A6 (0.67) APPALDH5A1ABATALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021218992-A1 SUBSTITUTED PYRROLIDINE COMPOUND AND USE THEREOF IN MEDICINE 东莞市东阳光新药研发有限公司 2021-11-04 WO disclosed
EP-2357175-A1 isoquinoline derivatives AND THEIR USE IN INCREASING ENDOGENEOUS ERYTHROPOIETIN Fibrogen, Inc. (US) 2011-08-17 EP disclosed
EP-1644336-B1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS AND THEIR USE IN INCREASING ENDOGENEOUS ERYTHROPOIETIN FIBROGEN INC (US) 2011-01-19 EP disclosed
US-7338919-B2 Reversible thermosensitive recording medium and device, and image processing method and apparatus using the reversible thermosensitive recording medium RICOH COMPANY, LTD. (JP) 2008-03-04 US disclosed
EP-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
US-5840895-A INTERMEDIATES FOR ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1998-11-24 US disclosed
US-5686442-A ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-11-11 US disclosed
EP-0686636-A1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-12-13 EP disclosed
US-4327018-A Azo dyes and the production and use thereof CIBA-GEIGY CORPORATION (US) 1982-04-27 US disclosed
US-4256896-A THIAZOLE, IMIDAZOLINE, AND OXAZOLINE DYES; DISPERSE DYES; ANIONIC DYES; TEXTILES CIBA-GEIGY AKTIENGESELLSCHAFT (DE) 1981-03-17 US disclosed
US-4246422-A Naphtholactam dyestuffs CIBA-GEIGY AG (CH) 1981-01-20 US disclosed
US-4246410-A BENZINDOLE DYES OF YELLOW AND RED CIBA -GEIGY AKTIENGESELLSCHAFT (CH) 1981-01-20 US disclosed
US-4236007-A YELLOW SHADES ON POLYESTERS CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1980-11-25 US disclosed
US-4180665-A Substituted 3-benz(cd)indol-2-(1H)-ylidene-furo[2,3-b]quinoxalin-2(3H)one dyestuffs CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1979-12-25 US disclosed
US-4159379-A Dispersion dyestuffs of the naphtholactam series CIBA-GEIGY AG (CH) 1979-06-26 US disclosed
US-4148805-A POLYESTERS, RED, YELLLOW CIBA-GEIGY AG (CH) 1979-04-10 US disclosed
US-4146541-A YELLOW SHADE ON POLYESTERS CIBA-GEIGY AG (CH) 1979-03-27 US disclosed