SCHEMBL11457074

SCHEMBL11457074

O=C(CCF)N(c1ccc(F)cc1)C1CCCC1N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 15/20 0.42
▸ OPRK1 P41145 2/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 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
SCHEMBL11338319 0.96 SIGMAR1 (0.44) SIGMAR1OPRK1OPRM1MEN1ALDH1A1
SCHEMBL11446429 0.89 SIGMAR1 (0.51) SIGMAR1OPRK1MEN1ALDH1A1RAB9A
SCHEMBL11343008 0.85 SIGMAR1 (0.53) SIGMAR1OPRK1MEN1ALDH1A1RAB9A
SCHEMBL11338316 0.81 SIGMAR1 (0.44) SIGMAR1OPRK1OPRM1MEN1ALDH1A1
SCHEMBL11447938 0.81 SIGMAR1 (0.53) SIGMAR1OPRK1OPRM1
SCHEMBL11454746 0.79 SIGMAR1 (0.51) SIGMAR1OPRK1MEN1ALDH1A1RAB9A
SCHEMBL11454754 0.78 SIGMAR1 (0.53) SIGMAR1OPRK1OPRM1MEN1ALDH1A1
SCHEMBL11454732 0.77 SIGMAR1 (0.52) SIGMAR1OPRK1OPRM1MEN1ALDH1A1
SCHEMBL11446437 0.77 MEN1 (0.39) OPRM1MEN1ALDH1A1TP53KMT2A
SCHEMBL11341263 0.77 SIGMAR1 (0.55) SIGMAR1OPRK1OPRM1MEN1ALDH1A1

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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