SCHEMBL11569546

SCHEMBL11569546

C=CCNC1CC(Cl)CC1N(C(=O)CCOC)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 5/20 0.35
▸ LTB4R2 Q9NPC1 1/20 0.34
▸ CHRM2 P08172 2/20 0.32
▸ CHRM3 P20309 2/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ MITF O75030 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ HPGD P15428 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL11346418 0.91 ALDH1A1 (0.35) HTR1ALTB4R2CHRM2CHRM3MEN1
SCHEMBL11568723 0.87 KMT2A (0.36) HTR1ACHRM2CHRM3MEN1KMT2A
SCHEMBL11570684 0.87 KMT2A (0.36) HTR1ACHRM2CHRM3MEN1KMT2A
SCHEMBL11595050 0.83 KDM4E (0.43) CHRM2CHRM3MEN1KMT2AKDM4E
SCHEMBL11341461 0.78 KMT2A (0.40) HTR1ACHRM2CHRM3MEN1KMT2A
SCHEMBL11339668 0.78 KMT2A (0.40) HTR1ACHRM2CHRM3MEN1KMT2A
SCHEMBL11569547 0.78 PYGL (0.34) HTR1AMEN1KMT2ACYP1A2
SCHEMBL11346436 0.77 TACR2 (0.35) HTR1AMEN1KMT2AKDM4EALDH1A1
SCHEMBL11334003 0.75 KDM4E (0.44) CHRM2CHRM3MEN1KMT2AKDM4E
SCHEMBL11456609 0.74 ALDH1A1 (0.39) CHRM2CHRM3MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4159340-A N-(2-Aminocyclopentyl)-N-acylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
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