SCHEMBL7316950

SCHEMBL7316950

N=C(N)c1ccc(CNC(=O)[C@]23C[C@H]2CCN3C(=O)[C@@H](N)Cc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 18/20 0.51
PROC P04070 1/20 0.44
TPSAB1 Q15661 1/20 0.43
DPP4 P27487 1/20 0.42
F7 P08709 1/20 0.42

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
Hydrochloric Acid SCHEMBL7953121 0.99 F2 (0.52) F2PROCTPSAB1DPP4F7
SCHEMBL7311919 0.88 TPSAB1 (0.48) F2PROCTPSAB1
Hydrochloric Acid SCHEMBL7955507 0.87 TPSAB1 (0.48) F2PROCTPSAB1F7
SCHEMBL7393489 0.87 PROC (0.57) F2PROCF7
Hydrochloric Acid SCHEMBL7951695 0.86 PROC (0.56) F2PROCF7
SCHEMBL7307083 0.86 F2 (0.50) F2PROCTPSAB1
Hydrochloric Acid SCHEMBL7951637 0.85 F2 (0.51) F2PROCTPSAB1
SCHEMBL7315371 0.85 TMPRSS11D (0.51) F2
SCHEMBL7304476 0.84 F2 (0.47) F2PROCTPSAB1
Hydrochloric Acid SCHEMBL7944779 0.84 TMPRSS11D (0.50) F2

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-1050534-B1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2001-12-05 EP disclosed
EP-1050534-A1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-11-08 EP disclosed