SCHEMBL3189587

SCHEMBL3189587

O=C(Nc1ccc(I)cc1)N[C@H]1CC[C@H](OCc2c(F)cccc2F)CC1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 15/20 0.66
▸ EPHX1 P07099 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ FAAH O00519 2/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ AADAC P22760 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 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
SCHEMBL3189594 1.00 EPHX2 (0.66) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3190084 0.91 EPHX2 (0.68) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3190094 0.91 EPHX2 (0.68) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3178477 0.90 EPHX2 (0.72) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3178470 0.90 EPHX2 (0.72) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3181050 0.89 EPHX2 (0.72) EPHX2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3181043 0.89 EPHX2 (0.72) EPHX2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3192506 0.89 EPHX2 (0.66) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3192516 0.89 EPHX2 (0.66) EPHX2EPHX1ALDH1A1KDM4EFAAH
SCHEMBL3183168 0.89 EPHX2 (0.66) EPHX2EPHX1ALDH1A1KDM4EFAAH

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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