SCHEMBL20041091

SCHEMBL20041091

CCCC(=O)N1CCC(NC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.80
CXCR3 P49682 4/20 0.64
MEN1 O00255 1/20 0.57
UBE2M P61081 1/20 0.57
KMT2A Q03164 1/20 0.57
DCUN1D1 Q96GG9 1/20 0.57

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
SCHEMBL2730521 0.89 EPHX2 (1.00) EPHX2
SCHEMBL15155656 0.82 EPHX2 (0.82) EPHX2CXCR3
SCHEMBL27764410 0.82 EPHX2 (0.88) EPHX2
SCHEMBL2732185 0.80 EPHX2 (1.00) EPHX2MEN1UBE2MKMT2ADCUN1D1
SCHEMBL1444668 0.80 CXCR3 (0.62) EPHX2CXCR3MEN1UBE2MKMT2A
SCHEMBL6864334 0.80 CXCR3 (0.62) EPHX2CXCR3MEN1UBE2MKMT2A
SCHEMBL15170943 0.79 EPHX2 (0.84) EPHX2
SCHEMBL2716590 0.79 EPHX2 (1.00) EPHX2
SCHEMBL6863250 0.79 EPHX2 (0.62) EPHX2CXCR3
SCHEMBL14997499 0.79 EPHX2 (0.81) EPHX2

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
EP-2809650-B1 ACYL PIPERIDINE INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE UNIV CALIFORNIA (US) 2018-04-11 EP disclosed