SCHEMBL7148922

SCHEMBL7148922

O=C(NC(Cc1ccccc1)C(=O)CCl)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.64
CTSG P08311 1/20 0.60
CMA1 P23946 1/20 0.60
CTSL P07711 4/20 0.58
CTSS P25774 1/20 0.58
CTSK P43235 1/20 0.58
PTPN1 P18031 1/20 0.56
CTRB1 P17538 5/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
CA2 P00918 2/20 0.53
CA1 P00915 1/20 0.53

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
SCHEMBL6496041 1.00 ACE (0.64) ACECTSGCMA1CTSLCTSS
SCHEMBL9581939 0.86 ACE (0.66) ACECTSLCTSSCTSKPTPN1
SCHEMBL9581928 0.86 ACE (0.66) ACECTSLCTSSCTSKPTPN1
SCHEMBL5664274 0.85 CTSG (0.65) ACECTSGCMA1L3MBTL1
SCHEMBL4291672 0.85 CTSG (0.65) ACECTSGCMA1L3MBTL1
SCHEMBL6942656 0.85 CTSG (0.65) ACECTSGCMA1L3MBTL1
SCHEMBL528464 0.83 ACE (0.76) ACECTSLCTSSCTSKPTPN1
SCHEMBL111236 0.83 ACE (0.76) ACECTSLCTSSCTSKPTPN1
SCHEMBL111235 0.83 ACE (0.76) ACECTSLCTSSCTSKPTPN1
SCHEMBL11125543 0.83 ACE (0.75) ACECTSLCTSSCTSKPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1346972-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE HALOHYDRIN COMPOUND Ajinomoto Co., Inc. (JP) 2003-09-24 EP disclosed
US-5187290-A Hypotensive agents, analgesics E. R. SQUIBB & SONS, INC. (US) 1993-02-16 US disclosed
US-4736066-A Intermediate for substituted peptide compounds E. R. SQUIBB & SONS, INC. (US) 1988-04-05 US disclosed
EP-0154904-B1 ACYLAMINO OXO OR HYDROXY SUBSTITUTED ALKYLAMINO THIAZINES AND THIAZEPINES E.R. Squibb & Sons, Inc. (US) 1987-10-28 EP disclosed
US-4692455-A HYPOTENSIVE AGENTS, ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1987-09-08 US disclosed
US-4636522-A HYPOTENSIVE, ENZYME INHIBITORS, ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1987-01-13 US disclosed
US-4604402-A HYPOTENSIVE AGNETS E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed
EP-0159156-A1 Hydroxy substituted ureido amino and imino acids E.R. Squibb & Sons, Inc. (US) 1985-10-23 EP disclosed
EP-0154904-A1 Acylamino oxo or hydroxy substituted alkylamino thiazines and thiazepines E.R. Squibb & Sons, Inc. (US) 1985-09-18 EP disclosed
US-4535176-A HYPOTENSIVE AGENTS, ANALGESICS, ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1985-08-13 US disclosed
US-4514391-A HYPOTENSIVE AGENTS; ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1985-04-30 US disclosed
US-4512988-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1985-04-23 US disclosed
US-4474778-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1984-10-02 US disclosed
US-4470973-A HYPOTENSIVE AGENTS, ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1984-09-11 US disclosed