SCHEMBL11334028

SCHEMBL11334028

CCCC(=O)N(c1ccccc1)C1CCCC(Cl)CC1N(CC)CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ KDM4E B2RXH2 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
▸ PAX8 Q06710 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ OPRM1 P35372 4/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ OPRD1 P41143 2/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 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
SCHEMBL11341321 0.92 MITF (0.44) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11447041 0.92 TP53 (0.46) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11446986 0.83 ALDH1A1 (0.43) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11550110 0.83 MEN1 (0.41) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11447042 0.82 MEN1 (0.39) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11446647 0.81 TP53 (0.48) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11446523 0.80 TP53 (0.47) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11336631 0.80 ALDH1A1 (0.46) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11341207 0.80 ALDH1A1 (0.46) MEN1KMT2AKDM4ENPC1MITF
SCHEMBL11332173 0.80 ALDH1A1 (0.46) MEN1KMT2AKDM4ENPC1MITF

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-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-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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