SCHEMBL14435595

SCHEMBL14435595

N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(c2ccc(Cl)cc2CCCN2CCCC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 8/20 0.45
▸ DPP7 Q9UHL4 6/20 0.43
▸ DPP4 P27487 3/20 0.43
▸ FAP Q12884 1/20 0.43
▸ DPP8 Q6V1X1 1/20 0.43
▸ DPP9 Q86TI2 1/20 0.43
▸ MC4R P32245 1/20 0.43
▸ MC3R P41968 1/20 0.43
▸ MC1R Q01726 1/20 0.43
▸ HRH2 P25021 2/20 0.41
▸ HRH1 P35367 2/20 0.41
▸ OPRK1 P41145 1/20 0.40

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
SCHEMBL14431134 0.93 AKT1 (0.46) AKT1DPP7DPP4FAPDPP8
SCHEMBL14431088 0.90 HDAC8 (0.52) AKT1DPP4MC4R
SCHEMBL14435584 0.85 HRH1 (0.47) AKT1DPP7DPP4FAPDPP8
SCHEMBL14435563 0.84 HDAC8 (0.48) AKT1DPP4MC4R
SCHEMBL14435259 0.83 AKT1 (0.43) AKT1DPP7DPP4FAPDPP8
SCHEMBL14435265 0.83 AKT1 (0.43) AKT1DPP7DPP4FAPDPP8
SCHEMBL14435974 0.83 AKT1 (0.46) AKT1DPP7DPP4FAPDPP8
SCHEMBL14431138 0.81 HRH2 (0.48) MC4RHRH2HRH1
SCHEMBL14435216 0.80 HDAC8 (0.54) AKT1MC4ROPRK1
SCHEMBL14435602 0.79 AKT1 (0.47) AKT1DPP7DPP4FAPDPP8

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
WO-2007096186-A1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-08-30 — — WO disclosed
Send feedback