SCHEMBL7899274

SCHEMBL7899274

CN(C(=O)[C@@H](Cc1ccc2ccccc2c1)N(C)C1(C/C=C/C(=O)O)CCC1)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](C(C)(C)N)C1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.38
TACR1 P25103 7/20 0.36
OPRD1 P41143 1/20 0.35
PLAU P00749 2/20 0.35
F10 P00742 2/20 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
SCHEMBL866609 0.87 GHSR (0.44) GHSRTACR1OPRD1PLAUF10
SCHEMBL1401068 0.83 GHSR (0.53) GHSRTACR1OPRD1
SCHEMBL1401262 0.81 F10 (0.43) GHSRTACR1PLAUF10
SCHEMBL3394198 0.76 TACR1 (0.38) GHSRTACR1F10
SCHEMBL866610 0.75 GHSR (0.42) GHSRTACR1OPRD1PLAUF10
SCHEMBL866611 0.75 GHSR (0.42) GHSRTACR1OPRD1PLAUF10
SCHEMBL1401071 0.73 GHSR (0.52) GHSRTACR1OPRD1
SCHEMBL1401070 0.73 GHSR (0.52) GHSRTACR1OPRD1
SCHEMBL867608 0.73 GHSR (0.45) GHSRTACR1OPRD1
SCHEMBL7896416 0.73 GHSR (0.45) GHSRTACR1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1100824-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2001-05-23 EP disclosed
WO-2000001726-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-01-13 WO disclosed