SCHEMBL2309775

SCHEMBL2309775

OCCc1ccc2ccc3cccc(CCO)c3c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX5 P09917 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
BACE1 P56817 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37
MAPK1 P28482 1/20 0.36
MC5R P33032 1/20 0.36
PLAU P00749 1/20 0.36
SOX18 P35713 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL2312657 0.92 CYP1A2 (0.39) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2310758 0.89 KDM4E (0.38) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2310147 0.86 CYP1A2 (0.41) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2312805 0.83 CYP1A2 (0.42) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2310354 0.82 CYP1A2 (0.43) KDM4EALDH1A1CYP1A2CYP2D6CYP3A4
SCHEMBL2307941 0.80 CYP1A2 (0.42) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2308581 0.80 CYP1A2 (0.42) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2313474 0.80 ALDH1A1 (0.46) ALDH1A1CYP1A2CYP3A4MAPK1TDP1
SCHEMBL2310509 0.78 CYP1A2 (0.44) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2310086 0.78 CYP1A2 (0.50) ALDH1A1CYP1A2CYP2C19CYP2C9TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed