SCHEMBL3183334

SCHEMBL3183334

O=C(NC1CCCCCC1)N[C@H]1CC[C@H](OCc2c(F)cccc2F)CC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 10/20 0.67
▸ NPC1 O15118 5/20 0.51
▸ RAB9A P51151 5/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ EPHX1 P07099 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 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
SCHEMBL3180914 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3191258 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3191267 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3183341 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3192564 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3180907 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3192553 1.00 EPHX2 (0.67) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3179919 0.99 EPHX2 (0.68) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3179926 0.99 EPHX2 (0.68) EPHX2NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL3183713 0.86 EPHX2 (0.66) EPHX2NPC1RAB9AKMT2AMEN1

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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