SCHEMBL6559971

SCHEMBL6559971

C[C@@H](NC(=O)OCc1ccccc1)c1ccc(C(=O)O)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
ELANE P08246 1/20 0.47
OPRK1 P41145 4/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CTSK P43235 4/20 0.46
CTSL P07711 3/20 0.46
CTSS P25774 3/20 0.46
CTSB P07858 2/20 0.46
PTPN7 P35236 1/20 0.45
OPRM1 P35372 1/20 0.45
HTT P42858 1/20 0.45
DUSP3 P51452 1/20 0.45
CTRB1 P17538 2/20 0.44

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
SCHEMBL6559979 1.00 ATM (0.53) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6557686 0.92 ATM (0.52) ATMMEN1KMT2AALDH1A1ELANE
SCHEMBL6557676 0.92 ATM (0.52) ATMMEN1KMT2AALDH1A1ELANE
SCHEMBL6560303 0.86 ATM (0.53) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6560298 0.86 ATM (0.53) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6558121 0.83 POLB (0.54) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6558128 0.83 POLB (0.54) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6559021 0.82 ATM (0.49) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL6559027 0.82 ATM (0.49) ATMMEN1KMT2AALDH1A1KDM4E
SCHEMBL2851560 0.80 ATM (0.60) ATMMEN1KMT2AALDH1A1ELANE

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