SCHEMBL7791676

SCHEMBL7791676

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

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.54
F7 P08709 8/20 0.39
F3 P13726 8/20 0.39
XIAP P98170 1/20 0.37
F2 P00734 3/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
XBP1 P17861 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
THRB P10828 1/20 0.35
FPR1 P21462 3/20 0.35
FPR2 P25090 3/20 0.35
TP53 P04637 1/20 0.34
AGTR1 P30556 1/20 0.34
F10 P00742 2/20 0.34

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
SCHEMBL7785956 0.94 GHSR (0.56) GHSRF7F3XIAPF2
SCHEMBL7791760 0.94 GHSR (0.55) GHSRF7F3XIAPF2
SCHEMBL7795553 0.93 GHSR (0.53) GHSRF7F3XIAPF2
SCHEMBL7786009 0.92 GHSR (0.54) GHSRF7F3XIAPF2
SCHEMBL7786011 0.91 GHSR (0.57) GHSRF7F3XIAPF2
SCHEMBL7795578 0.91 GHSR (0.47) GHSRF7F3XIAPF2
SCHEMBL7796084 0.90 GHSR (0.67) GHSRF7F3XIAPF2
SCHEMBL7785733 0.90 GHSR (0.60) GHSRF7F3XIAPF2
SCHEMBL7786087 0.89 GHSR (0.53) GHSRF7F3XIAPMAPT
SCHEMBL7791541 0.89 GHSR (0.53) GHSRF7F3XIAPF2

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