SCHEMBL11454746

SCHEMBL11454746

O=C(CCBr)N(c1ccccc1)C1CCCC1N1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 16/20 0.51
▸ OPRK1 P41145 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MITF O75030 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ PAX8 Q06710 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL11339650 0.96 SIGMAR1 (0.53) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11341260 0.91 SIGMAR1 (0.43) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11446429 0.90 SIGMAR1 (0.51) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11447938 0.89 SIGMAR1 (0.53) SIGMAR1OPRK1
SCHEMBL11343008 0.86 SIGMAR1 (0.53) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11341263 0.85 SIGMAR1 (0.55) SIGMAR1OPRK1MEN1ALDH1A1RAB9A
SCHEMBL11447936 0.84 SIGMAR1 (0.41) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11336355 0.83 SIGMAR1 (0.50) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11336349 0.83 SIGMAR1 (0.50) SIGMAR1OPRK1KDM4EMEN1NPC1
SCHEMBL11338316 0.82 SIGMAR1 (0.44) SIGMAR1OPRK1KDM4EMEN1NPC1

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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