SCHEMBL7791728

SCHEMBL7791728

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

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.66
AGTR1 P30556 1/20 0.43
XIAP P98170 9/20 0.43
FPR1 P21462 3/20 0.38
FPR2 P25090 3/20 0.38
NPY1R P25929 1/20 0.37
TRPV1 Q8NER1 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
SCHEMBL7785552 0.94 GHSR (0.66) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7785927 0.94 GHSR (0.65) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7791643 0.94 GHSR (0.68) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7786112 0.92 GHSR (0.57) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL8328786 0.91 GHSR (0.69) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7795530 0.91 GHSR (0.66) GHSRAGTR1XIAPNPY1R
SCHEMBL7796023 0.90 GHSR (0.81) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7786180 0.89 GHSR (0.79) GHSRAGTR1XIAPNPY1R
SCHEMBL7791581 0.89 GHSR (0.67) GHSRAGTR1XIAPFPR1FPR2
SCHEMBL7791701 0.89 GHSR (0.66) GHSRAGTR1XIAPFPR1FPR2

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