SCHEMBL9556797

SCHEMBL9556797

Nc1ccc(CCCC(=O)N2CC=CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.45
▸ MAOB P27338 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ AR P10275 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL9556995 0.90 SIGMAR1 (0.40) SIGMAR1NPC1RAB9AAR
SCHEMBL9557038 0.86 TRPV1 (0.43) SIGMAR1MAOB
SCHEMBL9556815 0.84 NAAA (0.51) GFER
SCHEMBL9556919 0.84 NAAA (0.50) SIGMAR1NPC1RAB9AAR
SCHEMBL6966882 0.84 NPC1 (0.57) NPC1TDP1
SCHEMBL9556926 0.83 NPC1 (0.57) SIGMAR1NPC1RAB9AARTDP1
SCHEMBL9557012 0.80 SIGMAR1 (0.45) SIGMAR1NPC1RAB9AARTDP1
SCHEMBL9557147 0.80 FKBP1A (0.60) —
SCHEMBL9557047 0.80 ALDH1A1 (0.47) SIGMAR1NPC1RAB9AAR
SCHEMBL9556642 0.79 MAPT (0.56) SIGMAR1NPC1RAB9AARTDP1

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
US-5198450-A PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USAGE OF THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-03-30 — — US disclosed
EP-0424528-A1 PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 — — EP disclosed
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