SCHEMBL2312893

SCHEMBL2312893

OCCc1ccc2[nH]c3ccc(CCO)cc3c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
KDM4E B2RXH2 5/20 0.55
MAPT P10636 3/20 0.55
HPGD P15428 3/20 0.55
HSD17B10 Q99714 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX5 P09917 1/20 0.48
GAA P10253 1/20 0.48
BACE1 P56817 1/20 0.48
CA2 P00918 1/20 0.43
PIKFYVE Q9Y2I7 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 2/20 0.39
HTT P42858 1/20 0.39
HTR2C P28335 1/20 0.38
GFER P55789 1/20 0.38
PPARG P37231 1/20 0.37
AHR P35869 1/20 0.37
BAD Q92934 1/20 0.36

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
SCHEMBL2307656 0.92 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2311195 0.91 AHR (0.53) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2313068 0.83 KIF11 (0.48) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL29844524 0.82 ALDH1A1 (0.59) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL8161592 0.81 PTGS2 (0.48) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2309770 0.80 AR (0.41) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2310171 0.80 BCHE (0.38) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2312163 0.79 KIF11 (0.64) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL4960991 0.79 RIPK1 (0.50) ALDH1A1KDM4EMAPTHPGDHSD17B10
SCHEMBL2267028 0.79 KDM4E (0.53) ALDH1A1KDM4EMAPTHPGDHSD17B10

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