SCHEMBL3183168

SCHEMBL3183168

Cc1ccc(NC(=O)N[C@H]2CC[C@H](OCc3c(F)cccc3F)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 13/20 0.66
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ EPHX1 P07099 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ FAAH O00519 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
SCHEMBL3183175 1.00 EPHX2 (0.66) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3190094 0.91 EPHX2 (0.68) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3190084 0.91 EPHX2 (0.68) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3178470 0.90 EPHX2 (0.72) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3178477 0.90 EPHX2 (0.72) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3182573 0.89 EPHX2 (0.63) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3182568 0.89 EPHX2 (0.63) EPHX2NPC1RAB9AEPHX1ALDH1A1
SCHEMBL3188296 0.89 EPHX2 (0.72) EPHX2NPC1RAB9AALDH1A1MEN1
SCHEMBL3188291 0.89 EPHX2 (0.72) EPHX2NPC1RAB9AALDH1A1MEN1
SCHEMBL3189594 0.89 EPHX2 (0.66) EPHX2NPC1RAB9AEPHX1ALDH1A1

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-7662910-B2 Inhibitors for the soluble epoxide hydrolase THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-02-16 — — US claimed
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