SCHEMBL6557807

SCHEMBL6557807

CC(NC(=O)OCc1ccccc1)c1ccc(C(=O)Cl)cc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
CTSL P07711 7/20 0.45
CTSB P07858 7/20 0.45
ALDH1A1 P00352 1/20 0.44
GLRA1 P23415 1/20 0.43
GSTP1 P09211 1/20 0.42
GSTM2 P28161 1/20 0.42
PDK1 Q15118 1/20 0.42
MAPT P10636 3/20 0.42
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
NTSR1 P30989 1/20 0.41
CTSK P43235 2/20 0.41

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
SCHEMBL6557796 1.00 ATM (0.47) ATMCTSLCTSBALDH1A1GLRA1
SCHEMBL6559021 0.92 ATM (0.49) ATMCTSLCTSBALDH1A1GSTP1
SCHEMBL6559027 0.92 ATM (0.49) ATMCTSLCTSBALDH1A1GSTP1
SCHEMBL6557686 0.84 ATM (0.52) ATMCTSLCTSBALDH1A1GLRA1
SCHEMBL6557676 0.84 ATM (0.52) ATMCTSLCTSBALDH1A1GLRA1
SCHEMBL6558080 0.83 POLB (0.52) ATMALDH1A1MAPTHTTLMNA
SCHEMBL6558090 0.83 POLB (0.52) ATMALDH1A1MAPTHTTLMNA
SCHEMBL6558247 0.83 ATM (0.51) ATMCTSLCTSBGLRA1CTSK
SCHEMBL6558255 0.83 ATM (0.51) ATMCTSLCTSBGLRA1CTSK
SCHEMBL6558082 0.78 ATM (0.48) ATMCTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1391454-A1 Substituted benzamide compounds with antihypertensive activity Mitsubishi Pharma Corporation (JP) 2004-02-25 EP disclosed
EP-1195372-A1 N-heterocyclic substituted benzamide derivatives with antihypertensive activity Mitsubishi Pharma Corporation (JP) 2002-04-10 EP disclosed
US-6156766-A Benzamide compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-12-05 US disclosed
US-5958944-A TREATMENT OF CIRCULATORY DISEASES IN CORONARY, CEREBRAL, RENAL AND PERIPHERAL ARTERIES, AS A THERAPEUTIC AGENT FOR HYPERTENSION, ANGINA PECTORIS, AND RENAL AND PERIPHERAL CIRCULATION DISORDER, ANTIASTHMATIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-09-28 US disclosed
EP-0757038-A1 BENZAMIDE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-05 EP disclosed