SCHEMBL7791706

SCHEMBL7791706

CCC(=O)N[C@@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3CNC(=O)NCC(=O)OCc3ccccc3)cc2)C1=O

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.67
XIAP P98170 6/20 0.51
AGTR1 P30556 1/20 0.50
AVPR2 P30518 1/20 0.45
NPY1R P25929 5/20 0.44
PTGER1 P34995 2/20 0.44
PTGER3 P43115 2/20 0.44
PTGER4 P35408 1/20 0.44
PTGER2 P43116 1/20 0.44

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
SCHEMBL7791973 0.94 GHSR (0.69) GHSRXIAPAGTR1AVPR2NPY1R
SCHEMBL7794445 0.91 GHSR (0.62) GHSRXIAPAGTR1NPY1RPTGER1
SCHEMBL7795975 0.91 GHSR (0.71) GHSRXIAPAGTR1NPY1R
SCHEMBL7785880 0.90 GHSR (0.73) GHSRXIAPAGTR1NPY1RPTGER1
SCHEMBL8330701 0.89 GHSR (0.67) GHSRXIAPAGTR1AVPR2NPY1R
SCHEMBL7794451 0.88 GHSR (0.81) GHSRXIAPAGTR1NPY1R
SCHEMBL8328518 0.87 GHSR (0.66) GHSRXIAPAGTR1AVPR2NPY1R
SCHEMBL7785886 0.87 GHSR (0.73) GHSRXIAPAGTR1NPY1RPTGER1
SCHEMBL7785844 0.87 GHSR (0.80) GHSRXIAPAGTR1NPY1RPTGER1
SCHEMBL7786019 0.87 GHSR (0.80) GHSRXIAPAGTR1NPY1R

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-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 EP disclosed