SCHEMBL6559882

SCHEMBL6559882

NC1(c2ccc(C(=O)Nc3ccncc3)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
POLB P06746 3/20 0.60
MAPT P10636 3/20 0.60
KMT2A Q03164 2/20 0.58
NT5E P21589 1/20 0.58
GAA P10253 1/20 0.57
JAK2 O60674 1/20 0.57
TYK2 P29597 1/20 0.57
STAT3 P40763 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ROCK2 O75116 3/20 0.55
ROCK1 Q13464 3/20 0.55
HTT P42858 1/20 0.53
MAPK1 P28482 2/20 0.51
MITF O75030 1/20 0.51
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.50
NAMPT P43490 1/20 0.50
TP53 P04637 1/20 0.49

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
SCHEMBL14716526 0.82 KDM4E (1.00) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL30828552 0.79 KDM4E (0.85) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL30828582 0.79 KDM4E (0.85) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL23999623 0.79 KDM4E (0.85) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL13683754 0.78 NPC1 (0.51) KDM4EKMT2ANT5ESMN1; SMN2MAPK1
SCHEMBL1898755 0.78 GAA (0.91) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL11613305 0.77 POLB (0.87) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL28829404 0.77 KDM4E (0.81) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL19241698 0.77 KDM4E (0.88) KDM4EL3MBTL1POLBMAPTKMT2A
SCHEMBL5473502 0.76 ROCK2 (0.67) KDM4EL3MBTL1POLBMAPTKMT2A

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