SCHEMBL11528017

SCHEMBL11528017

CCC1(C)Cc2ccccc2C1=O

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.63
GAA P10253 5/20 0.63
PRNP P04156 3/20 0.58
RXFP1 Q9HBX9 3/20 0.58
PPARG P37231 2/20 0.58
NCOR2 Q9Y618 2/20 0.58
NR2E3 Q9Y5X4 1/20 0.58
ALDH1A1 P00352 7/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 1/20 0.52
NPSR1 Q6W5P4 5/20 0.51
HTT P42858 2/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HPGD P15428 2/20 0.47
PKM P14618 1/20 0.45
HSD17B10 Q99714 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL12086597 0.86 GAA (0.49) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL8076792 0.84 HTT (0.47) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL12086639 0.83 ALOX12 (0.55) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL12086636 0.81 NPSR1 (0.45) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL9342946 0.80 ALOX12 (0.49) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL9172913 0.79 NPSR1 (0.64) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL29448052 0.79 NPSR1 (0.64) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL23397542 0.78 LMNA (0.43) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL11931773 0.78 HTT (0.43) KDM4EGAAPRNPRXFP1PPARG
SCHEMBL11537833 0.77 GAA (0.44) KDM4EGAAPRNPRXFP1PPARG

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-4166131-A ANTIINFLAMMATORY AGENTS, ANTIPYRETICS, ANTIARTHRITIC AGENT HEXACHIMIE SOCIETE ANONYME (FR) 1979-08-28 US disclosed