SCHEMBL14291367

SCHEMBL14291367

Cc1ccc(C[C@@H](N)C(=O)N2CCN(C(=O)[C@H](N)Cc3ccc(C)cc3C)[C@@H](CCCCNCCN)C2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC4R P32245 4/20 0.36
DPP4 P27487 5/20 0.35
FAP Q12884 5/20 0.35
DPP8 Q6V1X1 5/20 0.35
DPP9 Q86TI2 5/20 0.35
DPP7 Q9UHL4 4/20 0.35
FPR3 P25089 2/20 0.34
FPR2 P25090 1/20 0.34
OPRM1 P35372 1/20 0.33
OPRK1 P41145 2/20 0.33
SOS1 Q07889 1/20 0.32

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
SCHEMBL2898105 0.86 DPP4 (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL2898102 0.86 DPP4 (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL5031635 0.86 MC4R (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748571 0.86 MC4R (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748573 0.86 MC4R (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL14147591 0.84 DPP4 (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748907 0.84 DPP4 (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748909 0.84 DPP4 (0.36) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748929 0.83 MC4R (0.37) MC4RDPP4FAPDPP8DPP9
SCHEMBL1748928 0.83 MC4R (0.37) MC4RDPP4FAPDPP8DPP9

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-2008017852-A1 DIAMINE-CONTAINING, TETRA- SUBSTITUTED PIPERAZINE COMPOUNDS AS MELANOCORTIN RECEPTOR MODULATORS PALATIN TECHNOLOGIES, INC. (US) 2008-02-14 WO disclosed