SCHEMBL8439136

SCHEMBL8439136

CCc1ccccc1CCC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.53
CYP4A11 Q02928 2/20 0.53
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
CDYL Q9Y232 1/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6209967 0.95 CYP4F2 (0.53) CYP4F2CYP4A11CDYLALDH1A1LMNA
SCHEMBL28212143 0.85 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1LMNAGAA
SCHEMBL2821947 0.85 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1
SCHEMBL14110364 0.84 CYP4F2 (0.41) CYP4F2CYP4A11MTNR1AMTNR1B
SCHEMBL29059884 0.83 CTSS (0.43) CYP4F2CYP4A11ALDH1A1LMNAL3MBTL1
SCHEMBL6987122 0.83 MEN1 (0.47) CYP4F2CYP4A11ALDH1A1MTNR1AMTNR1B
SCHEMBL16575622 0.83 CYP4F2 (0.43) CYP4F2CYP4A11ALDH1A1LMNAMTNR1A
SCHEMBL30339213 0.82 FOLH1 (0.51) CYP4F2CYP4A11ALDH1A1LMNAMTNR1A
SCHEMBL6802490 0.82 FOLH1 (0.51) CYP4F2CYP4A11ALDH1A1LMNAMTNR1A
SCHEMBL7286194 0.81 CDYL (0.56) CYP4F2CYP4A11CDYLMTNR1AL3MBTL1

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-5889178-A N-(2,2-DIPHENYLETHYL)-DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-03-30 US disclosed