SCHEMBL5756716

SCHEMBL5756716

O=c1oc(-c2ccc(C(F)(F)F)cc2)nn1Cc1cc(Cl)c(N2C=CNC2S)cc1O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.31
NOTUM Q6P988 2/20 0.30
GPR55 Q9Y2T6 1/20 0.30
KCNK3 O14649 1/20 0.30

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
SCHEMBL7954651 0.88 MAPT (0.35) KMT2AGAAGPR55
SCHEMBL5756172 0.79 KMT2A (0.36) KMT2AGAANOTUM
SCHEMBL5753883 0.79 KMT2A (0.41) KMT2AGAANOTUM
SCHEMBL5756713 0.78 KMT2A (0.35) KMT2AGAANOTUM
SCHEMBL29572389 0.76 KMT2A (0.41) KMT2AGAANOTUM
SCHEMBL5752911 0.76 KMT2A (0.41) KMT2AGAANOTUM
SCHEMBL5756424 0.71 KMT2A (0.36) KMT2AGAA
SCHEMBL5802067 0.70 POLB (0.45) KMT2AGAA
SCHEMBL5754016 0.70 ALDH1A1 (0.45) GAA
SCHEMBL27523763 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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