SCHEMBL3189486

SCHEMBL3189486

O=C(Nc1cccc(Cl)c1)N[C@H]1CC[C@H](OCc2c(F)cccc2F)CC1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 9/20 0.72
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ RAB9A P51151 4/20 0.59
▸ NPC1 O15118 3/20 0.59
▸ LMNA P02545 1/20 0.59
▸ EPHX1 P07099 1/20 0.59
▸ TSHR P16473 1/20 0.59
▸ ALDH1A1 P00352 3/20 0.54
▸ POLB P06746 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HTR1A P08908 1/20 0.46
▸ HTR7 P34969 1/20 0.46
▸ UBE2M P61081 1/20 0.46
▸ DCUN1D1 Q96GG9 1/20 0.46
▸ CXCR3 P49682 1/20 0.46

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
SCHEMBL3189493 1.00 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3194087 0.89 EPHX2 (0.66) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3194077 0.89 EPHX2 (0.66) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3182153 0.89 EPHX2 (0.74) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3182145 0.89 EPHX2 (0.74) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3178477 0.88 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3178470 0.88 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3181050 0.87 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3181043 0.87 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1
SCHEMBL3172705 0.87 EPHX2 (0.72) EPHX2MEN1KMT2ARAB9ANPC1

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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