SCHEMBL7786112

SCHEMBL7786112

CCCC(=O)N[C@@H]1CCc2cc(C(F)(F)F)ccc2N(Cc2ccc(-c3ccccc3CNC(N)=O)cc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.57
AGTR1 P30556 1/20 0.45
XIAP P98170 11/20 0.44
SCN9A Q15858 2/20 0.38
FPR1 P21462 1/20 0.37
FPR2 P25090 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
SCHEMBL7794419 0.94 GHSR (0.58) GHSRAGTR1XIAPSCN9AFPR1
SCHEMBL7791728 0.92 GHSR (0.66) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7785927 0.92 GHSR (0.65) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7785552 0.91 GHSR (0.66) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7785884 0.91 GHSR (0.59) GHSRAGTR1XIAPSCN9AFPR1
SCHEMBL7793136 0.91 GHSR (0.57) GHSRAGTR1XIAP
SCHEMBL7794461 0.90 GHSR (0.69) GHSRAGTR1XIAPSCN9A
SCHEMBL7791723 0.89 GHSR (0.68) GHSRAGTR1XIAP
SCHEMBL7785971 0.88 GHSR (0.56) GHSRAGTR1XIAP
SCHEMBL7791537 0.88 GHSR (0.56) GHSRAGTR1XIAP

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