SCHEMBL7300784

SCHEMBL7300784

O=[C]C(Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 2/20 0.61
TACR1 P25103 2/20 0.58
CTSL P07711 7/20 0.56
CTSS P25774 6/20 0.56
CTSK P43235 5/20 0.56
CTSB P07858 3/20 0.56
TRPM8 Q7Z2W7 1/20 0.52
ALDH1A1 P00352 1/20 0.52
ALOX15 P16050 1/20 0.52
ATM Q13315 1/20 0.50

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
SCHEMBL7310119 1.00 CTRB1 (0.61) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL4598612 1.00 CTRB1 (0.61) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL7288504 0.94 CTSL (0.56) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL10724398 0.94 CTSL (0.56) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL10724038 0.92 CTRB1 (0.53) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL10724041 0.92 CTRB1 (0.53) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL11669304 0.90 CTSL (0.63) CTRB1TACR1CTSLCTSSCTSK
SCHEMBL10720521 0.89 TACR1 (0.67) TACR1CTSLCTSSCTSKCTSB
SCHEMBL10720515 0.89 TACR1 (0.67) TACR1CTSLCTSSCTSKCTSB
SCHEMBL10720700 0.88 CYP3A4 (0.56) CTRB1TACR1CTSLCTSSCTSK

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4650785-A ORAL ADMINISTRATION OF INSULIN AJINOMOTO COMPANY INCOPORATED (JP) 1987-03-17 US claimed
US-4548926-A RENIN INHIBITOR SANKYO COMPANY LIMITED (JP) 1985-10-22 US claimed
EP-0128762-A2 New hypotensive peptides, their preparation and their use SANKYO COMPANY LIMITED (JP) 1984-12-19 EP claimed
EP-0093551-A2 Pharmaceutical composition AJINOMOTO CO., INC. (JP) 1983-11-09 EP claimed
JP-58189121-A None JP disclosed
JP-62026273-A None JP disclosed
CN-1092960-C Pharmaceutical composition containing protease inhibitor and monoglyceride HOFFMANN LA ROCHE (US) 2002-10-23 CN disclosed
US-6008228-A COMPRISING A MIXTURE OF CARRIER MONOGLYCERIDES OF MEDIUM CHAIN-FATTY ACIDS HOFFMAN-LA ROCHE INC. (US) 1999-12-28 US disclosed
CN-1186434-A Pharmaceutical composition containing protease inhibitor and monoglyceride HOFFMANN LA ROCHE (US) 1998-07-01 CN disclosed
EP-0594540-B1 Antiretroviral acyl compounds CIBA GEIGY AG (CH) 1998-04-01 EP disclosed
EP-0831826-A1 PHARMACEUTICAL COMPOSITION COMPRISING A PROTEINASE INHIBITOR AND A MONOGLYCERIDE F. HOFFMANN-LA ROCHE AG (CH) 1998-04-01 EP disclosed
WO-1996039142-A1 PHARMACEUTICAL COMPOSITION COMPRISING A PROTEINASE INHIBITOR AND A MONOGLYCERIDE F. HOFFMANN-LA ROCHE AG (CH) 1996-12-12 WO disclosed
JP-S6226273-A ISOQUINOLINE DERIVATIVE AND USE THEREOF AJINOMOTO CO INC 1987-02-04 JP disclosed
US-4613676-A PEPTIDES CIBA-GEIGY CORPORATION (US) 1986-09-23 US disclosed
US-4548926-A RENIN INHIBITOR SANKYO COMPANY LIMITED (JP) 1985-10-22 US disclosed
EP-0152255-A2 New renin-inhibitory peptides and their use SANKYO COMPANY LIMITED (JP) 1985-08-21 EP disclosed
EP-0128762-A2 New hypotensive peptides, their preparation and their use SANKYO COMPANY LIMITED (JP) 1984-12-19 EP disclosed
EP-0093551-A2 Pharmaceutical composition AJINOMOTO CO., INC. (JP) 1983-11-09 EP disclosed
EP-0093551-A2 Pharmaceutical composition AJINOMOTO CO., INC. (JP) 1983-11-09 EP disclosed
JP-S58189121-A ACTIVATOR FOR ADMINISTRATION OF INSULIN AJINOMOTO CO INC 1983-11-04 JP disclosed