SCHEMBL2313474

SCHEMBL2313474

OCCc1cccc2ccc3cccc(CCO)c3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 3/20 0.46
CYP1A2 P05177 2/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
HTR2A P28223 4/20 0.44
PPARG P37231 1/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HEXA P06865 1/20 0.37
HEXB P07686 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
THRB P10828 1/20 0.37
MTNR1A P48039 5/20 0.36
MTNR1B P49286 4/20 0.36
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL10339351 0.93 HTR2A (0.46) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL2310354 0.89 CYP1A2 (0.43) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL7930885 0.86 HTR2A (0.42) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL27366565 0.85 HTR2A (0.62) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL2310469 0.84 CYP1A2 (0.43) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL23043093 0.83 HTR2A (0.40) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL29876215 0.83 HTR2A (0.40) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL2314747 0.83 ALDH1A1 (0.46) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL2315939 0.83 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRCYP1A2HPGD
SCHEMBL2311141 0.82 CYP1A2 (0.47) ALDH1A1HSD17B10TSHRCYP1A2HPGD

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