SCHEMBL7440316

SCHEMBL7440316

CSCC[C@H](NC(=O)C(CSC(=O)c1ccccc1)Cc1ccccc1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.66
FNTA P49354 6/20 0.56
FNTB P49356 6/20 0.56
PGGT1B P53609 6/20 0.56
MME P08473 1/20 0.55
ANPEP P15144 1/20 0.55

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
SCHEMBL7440318 1.00 LTA4H (0.66) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL7318233 0.91 MME (0.56) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL7440341 0.90 MME (0.57) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL7440346 0.90 MME (0.57) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL7438012 0.89 LTA4H (0.69) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL11389773 0.89 LTA4H (0.69) LTA4HFNTAFNTBPGGT1BMME
Hydrochloric Acid SCHEMBL7438478 0.87 LTA4H (0.52) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL11123904 0.86 LTA4H (0.48) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL11257806 0.86 LTA4H (0.48) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL7441991 0.85 MME (0.52) LTA4HFNTAFNTBPGGT1BMME

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5262436-A Administering; enzyme inhibitor SCHERING CORPORATION (US) 1993-11-16 US disclosed
US-5061710-A Atrial natriuretic factors SCHERING CORPORATION (US) 1991-10-29 US disclosed
US-4929641-A DIURETICS, ANGIOTENSIN CONVERTING ENZYMES SCHERING CORPORATION (US) 1990-05-29 US disclosed