SCHEMBL6559992

SCHEMBL6559992

O=C(NCc1ccc(C(=O)Cl)c(OCc2ccccc2)c1)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.50
SGMS2 Q8NHU3 1/20 0.49
NPC1 O15118 1/20 0.47
PKM P14618 1/20 0.47
RAB9A P51151 1/20 0.47
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC3 O15379 1/20 0.46
HTT P42858 1/20 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
SCHEMBL6559986 0.90 PLAU (0.52) PLAUSGMS2NPC1PKMRAB9A
SCHEMBL7604271 0.87 NPC1 (0.52) PLAUSGMS2NPC1PKMRAB9A
SCHEMBL14524175 0.82 SGMS2 (0.49) PLAUSGMS2NPC1PKMRAB9A
SCHEMBL6560278 0.80 POLB (0.57) SGMS2
SCHEMBL17864888 0.78 LMNA (0.61) PLAUPKMMAPTL3MBTL1LMNA
SCHEMBL6558145 0.78 HDAC1 (0.62) PLAUL3MBTL1LMNASMN1; SMN2HDAC1
SCHEMBL4939266 0.77 MAOB (0.60) NPC1RAB9ALMNASMN1; SMN2
Benzyl Benzylcarbamate SCHEMBL1136818 0.77 PLAU (0.70) PLAULMNASMN1; SMN2HDAC1HDAC2
SCHEMBL31375951 0.76 PTGER1 (0.58) NPC1RAB9ASMN1; SMN2
Benzyl Benzylcarbamate SCHEMBL9998166 0.75 PLAU (0.68) PLAULMNASMN1; SMN2HDAC1HDAC2

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