SCHEMBL11447938

SCHEMBL11447938

O=C(CCBr)N(c1ccc(Br)cc1)C1CCCC1N1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 12/20 0.53
▸ CHRM2 P08172 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ CHRNA7 P36544 1/20 0.38
▸ L3MBTL3 Q96JM7 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRK1 P41145 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
SCHEMBL11341263 0.96 SIGMAR1 (0.55) SIGMAR1KCNH2HRH3CHRNA7OPRM1
SCHEMBL11457121 0.89 SIGMAR1 (0.55) SIGMAR1OPRM1OPRK1
SCHEMBL11454746 0.89 SIGMAR1 (0.51) SIGMAR1OPRK1
SCHEMBL11338303 0.86 SIGMAR1 (0.57) SIGMAR1CHRNA7OPRM1OPRK1
SCHEMBL11339650 0.85 SIGMAR1 (0.53) SIGMAR1OPRK1
SCHEMBL11446906 0.81 SIGMAR1 (0.39) SIGMAR1CHRM2CHRM3KCNH2HRH3
SCHEMBL11341260 0.81 SIGMAR1 (0.43) SIGMAR1CHRM2CHRM3OPRM1OPRK1
SCHEMBL11457074 0.81 SIGMAR1 (0.42) SIGMAR1OPRM1OPRK1
SCHEMBL11446429 0.79 SIGMAR1 (0.51) SIGMAR1OPRK1
SCHEMBL11454754 0.78 SIGMAR1 (0.53) SIGMAR1OPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4204003-A N-(2-Aminocyclopentyl)-N-alkanoylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1980-05-20 — — US disclosed
US-4159340-A N-(2-Aminocyclopentyl)-N-acylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
US-4157398-A N-(2-Aminocyclopentyl)acylanilides and treating depression THE UPJOHN COMPANY (US) 1979-06-05 — — US disclosed
US-4156733-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-05-29 — — US disclosed
US-4156015-A N-(2-Aminocyclopentyl)acylanilides and treating depression THE UPJOHN COMPANY (US) 1979-05-22 — — US disclosed
US-4148913-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-04-10 — — US disclosed
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