SCHEMBL7795578

SCHEMBL7795578

CCCC(=O)N[C@@H]1CSc2cc(C(F)(F)F)ccc2N(Cc2ccc(-c3ccccc3CNC(N)=O)cc2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.47
F7 P08709 12/20 0.43
F3 P13726 12/20 0.43
F2 P00734 4/20 0.41
XIAP P98170 1/20 0.38
F10 P00742 2/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AGTR1 P30556 1/20 0.37
THRB P10828 1/20 0.36

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
SCHEMBL7791760 0.92 GHSR (0.55) GHSRF7F3F2XIAP
SCHEMBL7795553 0.92 GHSR (0.53) GHSRF7F3F2XIAP
SCHEMBL7785960 0.92 GHSR (0.47) GHSRF7F3F2XIAP
SCHEMBL7791888 0.91 GHSR (0.46) GHSRF7F3F2XIAP
SCHEMBL7791676 0.91 GHSR (0.54) GHSRF7F3F2XIAP
SCHEMBL7791757 0.91 GHSR (0.56) GHSRF7F3F2XIAP
SCHEMBL7796037 0.90 GHSR (0.51) GHSRF7F3F2XIAP
SCHEMBL7794624 0.89 GHSR (0.45) GHSRF7F3F2XIAP
SCHEMBL7791816 0.89 GHSR (0.45) GHSRF7F3F2XIAP
SCHEMBL7786112 0.87 GHSR (0.57) GHSRXIAPAGTR1

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