SCHEMBL9809018

SCHEMBL9809018

CSCSC[C@H](N)C(=O)NC(=O)C(CCSC(=O)c1ccccc1)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 6/20 0.40
FNTB P49356 6/20 0.40
PGGT1B P53609 6/20 0.40
MME P08473 1/20 0.39
ANPEP P15144 1/20 0.39
LTA4H P09960 1/20 0.37
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36

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
SCHEMBL9809054 1.00 FNTA (0.40) FNTAFNTBPGGT1BMMEANPEP
SCHEMBL9809021 0.84 LTA4H (0.45) FNTAFNTBPGGT1BMMEANPEP
SCHEMBL9808978 0.82 CYP1A2 (0.51) MMEANPEPLTA4HSLC1A3SLC1A2
SCHEMBL9808993 0.82 CYP1A2 (0.51) MMEANPEPLTA4HSLC1A3SLC1A2
SCHEMBL9808968 0.82 CYP1A2 (0.51) MMEANPEPLTA4HSLC1A3SLC1A2
SCHEMBL9808980 0.75 SLC1A3 (0.37) MMEANPEPSLC1A3SLC1A2SLC1A1
SCHEMBL9808994 0.75 SLC1A3 (0.37) MMEANPEPSLC1A3SLC1A2SLC1A1
SCHEMBL7318233 0.69 MME (0.56) FNTAFNTBPGGT1BMMEANPEP
SCHEMBL7440318 0.68 LTA4H (0.66) FNTAFNTBPGGT1BMMEANPEP
SCHEMBL7440316 0.68 LTA4H (0.66) FNTAFNTBPGGT1BMMEANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0322633-B1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1991-05-22 EP claimed
EP-0390839-A1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1990-10-10 EP claimed
EP-0322633-A1 Mercapto-acylamino acid antihypertensives SCHERING CORPORATION (US) 1989-07-05 EP claimed
WO-1989005796-A1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1989-06-29 WO claimed
EP-0322633-B1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1991-05-22 EP disclosed
EP-0390839-A1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1990-10-10 EP disclosed
EP-0322633-A1 Mercapto-acylamino acid antihypertensives SCHERING CORPORATION (US) 1989-07-05 EP disclosed
WO-1989005796-A1 MERCAPTO-ACYLAMINO ACID ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1989-06-29 WO disclosed