SCHEMBL4837047

SCHEMBL4837047

O=C(Oc1nn(C(=O)N2CCSCC2)c2cc(F)ccc12)ON1CCSCC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
DPP4 P27487 3/20 0.32
DPP7 Q9UHL4 2/20 0.32
RIPK1 Q13546 1/20 0.32
CHRM4 P08173 1/20 0.32
ADORA2A P29274 1/20 0.31
PTGS2 P35354 1/20 0.31
DPP8 Q6V1X1 1/20 0.30

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
SCHEMBL2965248 0.87 NPC1 (0.36) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL16242493 0.82 FAAH (0.42) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL4828449 0.82 SPR (0.34)
SCHEMBL4829941 0.77 GRM4 (0.34) NPC1ALDH1A1MEN1KMT2A
SCHEMBL2955527 0.72 GAA (0.43) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL2961336 0.71 ALOX15 (0.52) ALDH1A1
SCHEMBL2956860 0.71 SPR (0.36)
SCHEMBL1573644 0.70 RAB9A (0.39) NPC1RAB9AALDH1A1
SCHEMBL16242496 0.68 SPR (0.32) RAB9A
SCHEMBL2958195 0.68 PRMT5 (0.38) ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937648-B1 DIACYL INDAZOL DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS SANOFI SA (FR) 2014-11-26 EP disclosed
EP-1937648-A1 DIACYL INDAZOL DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS sanofi-aventis (FR) 2008-07-02 EP disclosed
WO-2007042178-A1 DIACYL INDAZOL DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS SANOFI-AVENTIS (DE) 2007-04-19 WO disclosed