SCHEMBL2310967

SCHEMBL2310967

OCCc1cc(CCO)c2ccc3c4ccccc4ccc3c2c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 5/20 0.45
CYP1A2 P05177 3/20 0.41
CYP2C19 P33261 3/20 0.41
CYP2D6 P10635 2/20 0.41
ANPEP P15144 1/20 0.41
CYP2C9 P11712 2/20 0.41
HIF1A Q16665 2/20 0.39
CYP3A4 P08684 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.39
CYP1B1 Q16678 1/20 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
SCHEMBL2311069 0.98 HPRT1 (0.42) HPRT1CYP1A2CYP2C19CYP2D6ANPEP
SCHEMBL2307222 0.92 CYP1A2 (0.47) HPRT1CYP1A2CYP2C19CYP2D6ANPEP
SCHEMBL2309813 0.89 CYP1A2 (0.47) HPRT1CYP1A2CYP2C19CYP2D6ANPEP
SCHEMBL2314155 0.87 CYP1A2 (0.44) HPRT1CYP1A2CYP2C19CYP2D6ANPEP
SCHEMBL2313600 0.85 CYP1A2 (0.42) CYP1A2CYP2C19CYP2D6CYP2C9HIF1A
SCHEMBL2313668 0.84 HPRT1 (0.42) HPRT1CYP1A2CYP2C19CYP2D6CYP2C9
SCHEMBL2308721 0.84 TDP1 (0.42) HPRT1CYP1A2CYP2C19CYP2D6CYP2C9
SCHEMBL2312897 0.83 CYP1A2 (0.57) HPRT1CYP1A2CYP2C19CYP2D6CYP2C9
SCHEMBL2308691 0.82 CYP1A2 (0.42) HPRT1CYP1A2CYP2C19CYP2D6CYP2C9
SCHEMBL2312666 0.81 HPRT1 (0.54) HPRT1CYP1A2CYP2C19CYP2D6CYP2C9

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