SCHEMBL11332175

SCHEMBL11332175

CN(C)C1CCCCCC1N(C(=O)CCCl)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ CNR2 P34972 1/20 0.39
▸ POLB P06746 2/20 0.36
▸ HTT P42858 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ BCL2A1 Q16548 1/20 0.35

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
SCHEMBL11446841 0.96 SIGMAR1 (0.40) SIGMAR1MEN1KMT2ANPC1ALDH1A1
Fumaric Acid SCHEMBL11332169 0.93 MEN1 (0.39) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11341133 0.91 RAB9A (0.40) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11330943 0.90 MEN1 (0.40) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11341323 0.90 CNR2 (0.43) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11338205 0.90 MITF (0.53) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11330691 0.89 SIGMAR1 (0.38) SIGMAR1MEN1KMT2ANPC1ALDH1A1
Fumaric Acid SCHEMBL11447589 0.89 ALDH1A1 (0.37) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11346088 0.87 SIGMAR1 (0.37) SIGMAR1MEN1KMT2ANPC1ALDH1A1
SCHEMBL11331266 0.87 SMN1; SMN2 (0.41) SIGMAR1MEN1KMT2ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US claimed
US-RE30837-E ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1981-12-29 — — US disclosed
US-4199589-A N-(2-Aminocycloheptyl)acylanilides and methods to treat depression SZMUSZKOVICZ JACOB (US) 1980-04-22 — — US disclosed
US-4172898-A N-(2-aminocycloheptyl)acylanilides THE UPJOHN COMPANY (US) 1979-10-30 — — US disclosed
US-4169156-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-09-25 — — US disclosed
US-4159339-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
US-4159339-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US disclosed
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US disclosed
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