SCHEMBL7794419

SCHEMBL7794419

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

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.58
AGTR1 P30556 1/20 0.48
XIAP P98170 10/20 0.45
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
SCN9A Q15858 2/20 0.38
FPR1 P21462 1/20 0.38
FPR2 P25090 1/20 0.38

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
SCHEMBL7786112 0.94 GHSR (0.57) GHSRAGTR1XIAPSCN9AFPR1
SCHEMBL7785884 0.94 GHSR (0.59) GHSRAGTR1XIAPSCN9AFPR1
SCHEMBL7791701 0.92 GHSR (0.66) GHSRAGTR1XIAPCYP11B1CYP11B2
SCHEMBL7791643 0.92 GHSR (0.68) GHSRAGTR1XIAPCYP11B1CYP11B2
SCHEMBL7794461 0.91 GHSR (0.69) GHSRAGTR1XIAPSCN9A
SCHEMBL7791581 0.91 GHSR (0.67) GHSRAGTR1XIAPCYP11B1CYP11B2
SCHEMBL7792980 0.90 GHSR (0.58) GHSRAGTR1XIAP
SCHEMBL7785875 0.89 GHSR (0.70) GHSRAGTR1XIAP
SCHEMBL7795488 0.88 GHSR (0.57) GHSRAGTR1XIAP
SCHEMBL7795397 0.88 GHSR (0.57) 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 1 patent. 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