SCHEMBL14920210

SCHEMBL14920210

O=C(O)N1CC2(C1)CN(S(=O)(=O)c1ccc(Cl)cc1Cl)C2

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.52
▸ TRPV4 Q9HBA0 10/20 0.49
▸ HSD11B1 P28845 1/20 0.46
▸ TRPM8 Q7Z2W7 2/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ ACLY P53396 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ CNR1 P21554 1/20 0.42
▸ TSHR P16473 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ ALOX15 P16050 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL23850293 0.87 EPHX2 (0.47) EPHX2TRPV4TRPM8KCNH2ALDH1A1
SCHEMBL14892785 0.81 EPHX2 (0.68) EPHX2TRPV4HTT
SCHEMBL22531044 0.78 KMT2A (0.55) EPHX2ALDH1A1MAPT
SCHEMBL17707671 0.74 EPHX2 (0.50) EPHX2TRPV4HSD11B1TRPM8KCNH2
SCHEMBL493523 0.73 ALDH1A1 (0.74) TRPV4HSD11B1ALDH1A1MAPTTSHR
SCHEMBL3925070 0.72 KMT2A (0.57) EPHX2TRPV4HSD11B1ALDH1A1CNR1
SCHEMBL23390426 0.72 MAPT (0.54) TRPV4TRPM8KCNH2ALDH1A1MAPT
SCHEMBL25301193 0.72 EPHX2 (0.48) EPHX2TRPV4HSD11B1TSHR
SCHEMBL23850261 0.72 TRPV4 (0.44) TRPV4ALDH1A1TSHRL3MBTL1
SCHEMBL29948811 0.72 MAPT (0.54) TRPV4TRPM8KCNH2ALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773644-A1 AZETIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE F.HOFFMANN-LA ROCHE AG (CH) 2014-09-10 — — EP claimed
WO-2013064467-A1 AZETIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE F. HOFFMANN-LA ROCHE AG (CH) 2013-05-10 — — WO claimed
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