SCHEMBL5757388

SCHEMBL5757388

COc1cc(NC(C)=O)c(Cl)cc1Cn1nc(-c2ccc(Cl)c(Cl)c2)oc1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.40
NOTUM Q6P988 1/20 0.39
USP2 O75604 2/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DRD2 P14416 2/20 0.37
DRD4 P21917 2/20 0.37
DRD3 P35462 2/20 0.37
MAPT P10636 3/20 0.36
AGER Q15109 1/20 0.36
TP53 P04637 1/20 0.36
ALDH1A1 P00352 2/20 0.35
FAAH O00519 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MOK Q9UQ07 2/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL7952081 0.89 RAB9A (0.41) RAB9AUSP2GAAMAPK1NPSR1
SCHEMBL7950977 0.89 AGER (0.37) RAB9AUSP2GAAMAPK1NPSR1
SCHEMBL7956984 0.88 TP53 (0.41) USP2GAAMAPK1NPSR1MAPT
SCHEMBL5755180 0.82 FAAH (0.38) NOTUMGAANPSR1MAPTFAAH
SCHEMBL7944633 0.78 TP53 (0.44) USP2GAAMAPTTP53ALDH1A1
SCHEMBL7952239 0.77 TP53 (0.41) GAAMAPTTP53ALDH1A1SMN1; SMN2
SCHEMBL7950910 0.74 TP53 (0.44) USP2GAAMAPK1NPSR1MAPT
SCHEMBL7957493 0.74 POLB (0.53) USP2MAPK1NPSR1MAPTTP53
SCHEMBL7943945 0.71 KMT2A (0.39) NOTUMGAA
SCHEMBL5752890 0.70 KMT2A (0.39) NOTUMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915856-A4 DIPHENYL HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS BRISTOL MYERS SQUIBB CO (US) 2006-04-12 EP disclosed
US-6271249-B1 Diphenyl imidazoles as potassium channel modulators BRISTOL-MYERS SQUIBB COMPANY 2001-08-07 US disclosed
US-6077861-A MODULATORS OF THE LARGE-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM (BK) CHANNELS, THEREFORE, USEFUL IN THE TREATMENT OF ISCHEMIC STROKE BRISTOL-MYERS SQUIBB COMPANY (US) 2000-06-20 US disclosed
EP-0915856-A1 DIPHENYL HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS Bristol-Myers Squibb Company (US) 1999-05-19 EP disclosed
US-5869509-A TREAT DISORDERS RESPONSIVE TO OPENERS OF THE LARGE CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-02-09 US disclosed
WO-1998004135-A1 DIPHENYL HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-02-05 WO disclosed