SCHEMBL5755628

SCHEMBL5755628

COc1cc(N)c(Cl)cc1Cn1nc(-c2ccc(C(F)(F)F)cc2)oc1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 2/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
RAB9A P51151 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
NPBWR1 P48145 1/20 0.36
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
GAA P10253 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 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
SCHEMBL5755180 0.86 FAAH (0.38) ABHD6MAPTKMT2ASMN1; SMN2NPSR1
SCHEMBL5753883 0.85 KMT2A (0.41) ABHD6KMT2AKDM4EGAAGABRP
SCHEMBL7141017 0.85 ABHD6 (0.43) ABHD6MAPTKMT2ASMN1; SMN2RAB9A
SCHEMBL7956984 0.84 TP53 (0.41) ABHD6MAPTKMT2ASMN1; SMN2NPSR1
SCHEMBL7944633 0.82 TP53 (0.44) ABHD6MAPTKMT2ASMN1; SMN2HPGD
SCHEMBL7950885 0.82 MAPT (0.36) ABHD6MAPTKMT2ASMN1; SMN2RAB9A
SCHEMBL7954470 0.81 TNKS (0.39) KMT2ARAB9ANPBWR1GABRPGABRD
SCHEMBL7952239 0.80 TP53 (0.41) ABHD6MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL7954648 0.80 GAA (0.38) ABHD6MAPTKMT2ASMN1; SMN2RAB9A
SCHEMBL7954651 0.80 MAPT (0.35) ABHD6MAPTKMT2ASMN1; SMN2RAB9A

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