SCHEMBL17130353

SCHEMBL17130353

CCC(C)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 14/20 0.63
▸ LIPE Q05469 1/20 0.54
▸ ADAMTS5 Q9UNA0 1/20 0.48
▸ CCR1 P32246 2/20 0.48
▸ P2RY14 Q15391 1/20 0.47

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
SCHEMBL24340329 0.83 ADAMTS5 (0.61) ADAMTS5CCR1
SCHEMBL23873216 0.79 LIPE (0.47) EPHX2LIPECCR1P2RY14
SCHEMBL2636716 0.79 LIPE (0.52) LIPEP2RY14
SCHEMBL31487378 0.79 RBP4 (0.63) EPHX2
SCHEMBL8220312 0.78 LIPE (0.50) EPHX2LIPEP2RY14
SCHEMBL17130354 0.78 EPHX2 (0.66) EPHX2ADAMTS5
SCHEMBL23873320 0.78 CHRM2 (0.44) EPHX2LIPECCR1P2RY14
SCHEMBL5535882 0.77 LIPE (0.51) LIPECCR1P2RY14
SCHEMBL2730089 0.77 EPHX2 (1.00) EPHX2
SCHEMBL15155469 0.77 EPHX2 (1.00) 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
WO-2015148954-A1 POTENT SOLUBLE EPOXIDE HYDROLASE INHIBITORS EICOSIS, LLC (US) 2015-10-01 — — WO disclosed
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