SCHEMBL4369760

SCHEMBL4369760

CCOC(=O)OC1(Cc2ccccc2)CCN(C(=O)[C@@H](Cc2ccc(-c3ccccc3)cc2)N(C)C(=O)/C=C/CC(C)(C)N)CC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.48
ADORA1 P30542 1/20 0.34
P2RX7 Q99572 1/20 0.34
CCKBR P32239 2/20 0.32
P2RY12 Q9H244 1/20 0.32
DPP4 P27487 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
SCHEMBL4369742 0.91 GHSR (0.48) GHSRDPP4
SCHEMBL4377376 0.89 GHSR (0.48) GHSR
SCHEMBL4375272 0.88 GHSR (0.35) GHSRADORA1P2RX7CCKBRP2RY12
SCHEMBL867765 0.88 GHSR (0.51) GHSR
SCHEMBL867766 0.88 GHSR (0.51) GHSR
SCHEMBL867082 0.83 GHSR (0.51) GHSRCCKBRDPP4
SCHEMBL867083 0.83 GHSR (0.51) GHSRCCKBRDPP4
SCHEMBL4382914 0.80 GHSR (0.50) GHSRDPP4
SCHEMBL4382952 0.80 OPRD1 (0.38) GHSRADORA1P2RX7DPP4
SCHEMBL866628 0.79 GHSR (0.51) GHSR

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-1077941-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2009-08-12 EP claimed