SCHEMBL14700520

SCHEMBL14700520

COc1ccc(C2(c3ccc(OC(C)=O)c(C)c3)c3ccc(-c4ccccc4)cc3-c3cc(-c4ccccc4)ccc32)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.39
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
FFAR1 O14842 1/20 0.39
BACE1 P56817 4/20 0.39
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A9 P48067 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
TSHR P16473 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
CHRM5 P08912 2/20 0.36
EDNRB P24530 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
SCHEMBL822520 0.86 ESR1 (0.52) BACE1TSHRESR1ESR2CHRM5
SCHEMBL14287530 0.78 ESR1 (0.49) BACE1MEN1KMT2AESR1ESR2
SCHEMBL14700552 0.78 ALOX5 (0.41) MEN1KMT2ATSHRESR1ESR2
SCHEMBL14700590 0.78 CHRM5 (0.40) TSHRESR1ESR2CHRM5
SCHEMBL14700587 0.78 CFD (0.53) CFDFFAR1BACE1MEN1KMT2A
SCHEMBL17148016 0.77 BACE1 (0.44) BACE1MAOBMEN1KMT2AADORA3
SCHEMBL29609097 0.77 SLC6A9 (0.44) RARARARBRARGSLC6A9ESR1
SCHEMBL22187702 0.77 SLC6A9 (0.44) RARARARBRARGSLC6A9ESR1
SCHEMBL10016827 0.76 CFD (0.54) CFDFFAR1BACE1MEN1KMT2A
SCHEMBL12578507 0.76 ESR1 (0.49) MEN1KMT2AESR1ESR2CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130040234-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, MANUFACTURING METHOD THEREFOR AND ELECTROPHOTOGRAPHIC DEVICE FUJI ELECTRIC CO., LTD. (JP) 2013-02-14 US disclosed