SCHEMBL2767559

SCHEMBL2767559

CN(C(=O)c1cccc(-c2cccc(F)c2)n1)c1ccc(CN2CCN(C(=O)O)[C@@](C)(C(C)(C)C)C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MLNR O43193 18/20 0.48
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
MCHR1 Q99705 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
SCHEMBL2802496 0.86 MLNR (0.62) MLNR
SCHEMBL2766677 0.86 MLNR (0.48) MLNRMCHR1
SCHEMBL2766964 0.82 MLNR (0.41) MLNRMCHR1
SCHEMBL4134228 0.81 MLNR (0.59) MLNRMCHR1
SCHEMBL3570120 0.80 MLNR (0.53) MLNR
SCHEMBL3562286 0.79 MLNR (0.58) MLNR
SCHEMBL3559461 0.79 MLNR (0.60) MLNR
SCHEMBL3564356 0.76 MLNR (0.65) MLNR
SCHEMBL2767430 0.76 MCHR1 (0.42) MLNRMCHR1
SCHEMBL377588 0.76 CHRM4 (0.45) MLNR

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
EP-2041093-B1 PIPERAZINYL DERIVATIVES USEFUL IN THE TREATMENT OF GPR38 RECEPTOR MEDIATED DISEASES GLAXO GROUP LTD (GB) 2010-04-21 EP disclosed