SCHEMBL7679198

SCHEMBL7679198

CC(C)(N)C(=O)N[C@H](COC(=O)c1ccccc1)C(=O)N1CCN2C(=O)N(CC(F)(F)F)C(=O)[C@]2(Cc2ccccn2)C1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.49
ELANE P08246 2/20 0.30
KCNH2 Q12809 1/20 0.30
SCN5A Q14524 1/20 0.30
SCN9A Q15858 1/20 0.30

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
SCHEMBL5224961 0.89 GHSR (0.55) GHSR
SCHEMBL3840114 0.89 GHSR (0.55) GHSR
SCHEMBL5227898 0.86 GHSR (0.45) GHSR
SCHEMBL5224946 0.86 GHSR (0.45) GHSR
SCHEMBL5225623 0.86 GHSR (0.53) GHSR
SCHEMBL5226424 0.86 GHSR (0.56) GHSRSCN9A
SCHEMBL5224876 0.86 GHSR (0.53) GHSR
SCHEMBL5226469 0.86 GHSR (0.56) GHSRSCN9A
Hydrochloric Acid SCHEMBL7687555 0.85 GHSR (0.45) GHSR
SCHEMBL5226022 0.84 GHSR (0.70) GHSRSCN9A

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
US-6429313-B2 Dipeptide derivatives PFIZER INC. 2002-08-06 US disclosed