SCHEMBL11334875

SCHEMBL11334875

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

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 1/20 0.53
FNTA P49354 10/20 0.44
FNTB P49356 10/20 0.44
PGGT1B P53609 10/20 0.44
LTA4H P09960 1/20 0.43

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
SCHEMBL11331433 0.86 CPB2 (0.57) CPB2
SCHEMBL11333852 0.85 CPB2 (0.53) CPB2
SCHEMBL11336752 0.85 CPB2 (0.56) CPB2
SCHEMBL8938649 0.84 FNTA (0.43) FNTAFNTBPGGT1BLTA4H
SCHEMBL8938646 0.84 FNTA (0.43) FNTAFNTBPGGT1BLTA4H
SCHEMBL11321753 0.84 CPB2 (0.55) CPB2
SCHEMBL11325107 0.83 FNTA (0.53) CPB2FNTAFNTBPGGT1B
SCHEMBL11433243 0.83 CPB2 (0.64) CPB2
SCHEMBL11430631 0.80 LTA4H (0.43) FNTAFNTBPGGT1BLTA4H
SCHEMBL11326734 0.79 GNPAT (0.50) CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4284779-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1981-08-18 US disclosed
US-4284780-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1981-08-18 US disclosed
US-4179434-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-12-18 US disclosed
US-4177277-A INHIBITION OF ANGIOTENSIN-CONVERTING ENZYME E. R. SQUIBB & SONS, INC. (US) 1979-12-04 US disclosed
US-4165320-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-08-21 US disclosed
US-4156786-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-05-29 US disclosed
US-4154946-A Amino mercapto substituted acylamino acids E. R. SQUIBB & SONS, INC. (US) 1979-05-15 US disclosed
US-4154960-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-05-15 US disclosed
US-4146611-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1979-03-27 US disclosed
US-4129571-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1978-12-12 US disclosed
US-4113715-A Amino acid derivatives E. R. SQUIBB & SONS, INC. (US) 1978-09-12 US disclosed