SCHEMBL7791668

SCHEMBL7791668

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

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.55
XIAP P98170 1/20 0.40
F7 P08709 7/20 0.38
F3 P13726 7/20 0.38
F2 P00734 3/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
XBP1 P17861 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
AGTR1 P30556 1/20 0.37
THRB P10828 1/20 0.37
FPR1 P21462 3/20 0.36
FPR2 P25090 3/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
F10 P00742 2/20 0.35

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
SCHEMBL7795553 0.94 GHSR (0.53) GHSRXIAPF7F3F2
SCHEMBL7794478 0.94 GHSR (0.56) GHSRXIAPF7F3F2
SCHEMBL7785956 0.93 GHSR (0.56) GHSRXIAPF7F3F2
SCHEMBL8333260 0.91 GHSR (0.66) GHSRXIAPF7F3F2
SCHEMBL7794362 0.91 GHSR (0.54) GHSRXIAPF7F3F2
SCHEMBL7785874 0.90 GHSR (0.60) GHSRXIAPF7F3F2
SCHEMBL7791998 0.89 GHSR (0.57) GHSRXIAPF7F3F2
SCHEMBL7791760 0.89 GHSR (0.55) GHSRXIAPF7F3F2
SCHEMBL7786077 0.89 GHSR (0.53) GHSRXIAPMAPTAGTR1
SCHEMBL7791686 0.89 GHSR (0.53) 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