SCHEMBL7984274

SCHEMBL7984274

COC(=O)c1ccccc1CCCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53
GPR119 Q8TDV5 13/20 0.49
EED O75530 1/20 0.48
RBBP4 Q09028 1/20 0.48
SUZ12 Q15022 1/20 0.48
EZH2 Q15910 1/20 0.48
AEBP2 Q6ZN18 1/20 0.48
STS P08842 1/20 0.47
FAAH O00519 1/20 0.46
TGFBR1 P36897 1/20 0.45

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
SCHEMBL15058311 0.88 KDM4E (0.56) KDM4EPKMGPR119EEDRBBP4
SCHEMBL4151572 0.84 TGFBR1 (0.53) KDM4EPKMGPR119FAAHTGFBR1
SCHEMBL8233089 0.84 KDM4E (0.54) KDM4EPKMGPR119STSFAAH
SCHEMBL7982886 0.81 KDM1A (0.45) KDM4E
SCHEMBL4144200 0.80 GPR119 (0.51) KDM4EPKMGPR119FAAH
SCHEMBL13913655 0.80 KDM4E (0.60) KDM4EPKMGPR119STSFAAH
SCHEMBL7495311 0.80 GPR119 (0.53) KDM4EPKMGPR119FAAH
SCHEMBL4152000 0.80 KDM4E (0.49) KDM4EPKMGPR119FAAHTGFBR1
SCHEMBL1475361 0.79 KDM4E (0.54) KDM4EPKMGPR119EEDRBBP4
SCHEMBL15629521 0.79 HTR2A (0.49) KDM4EPKMGPR119EEDRBBP4

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-6265434-B1 ANTIINFLAMMATORY AGENTS MERCK & CO., INC. 2001-07-24 US disclosed