SCHEMBL7785733

SCHEMBL7785733

CCCC(=O)N[C@@H]1CSc2ccccc2N(Cc2ccc(-c3ccccc3CNC(=O)NCCO)cc2)C1=O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.60
XIAP P98170 2/20 0.43
F7 P08709 4/20 0.42
F3 P13726 4/20 0.42
F2 P00734 1/20 0.40
ACE P12821 4/20 0.39
MME P08473 3/20 0.39
AGTR1 P30556 1/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL7792504 0.94 GHSR (0.60) GHSRXIAPF7F3F2
SCHEMBL7795546 0.94 GHSR (0.61) GHSRXIAPF7F3F2
SCHEMBL7786012 0.92 GHSR (0.59) GHSRXIAPF7F3F2
SCHEMBL7786009 0.91 GHSR (0.54) GHSRXIAPF7F3F2
SCHEMBL7786087 0.90 GHSR (0.53) GHSRXIAPF7F3DRD2
SCHEMBL7791541 0.90 GHSR (0.53) GHSRXIAPF7F3F2
SCHEMBL7791676 0.90 GHSR (0.54) GHSRXIAPF7F3F2
SCHEMBL7796037 0.90 GHSR (0.51) GHSRXIAPF7F3F2
SCHEMBL7792083 0.90 GHSR (0.64) GHSRXIAPF7F3F2
SCHEMBL7794541 0.89 GHSR (0.49) GHSRXIAPF7F3F2

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