SCHEMBL5752873

SCHEMBL5752873

COc1ccc(Cl)cc1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
MAPT P10636 2/20 0.57
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C9 P11712 2/20 0.57
CYP2C19 P33261 2/20 0.57
KMT2A Q03164 5/20 0.57
MEN1 O00255 3/20 0.57
POLB P06746 2/20 0.57
HDAC1 Q13547 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
ALDH1A1 P00352 3/20 0.55
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
LMNA P02545 1/20 0.53
KDM4E B2RXH2 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
METAP2 P50579 1/20 0.53

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
SCHEMBL5757229 0.91 MAPT (0.65) MAPK1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL7957397 0.89 POLB (0.72) MAPK1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL5753609 0.81 IGF1R (0.47) MAPK1MAPTCYP1A2CYP2C19KMT2A
SCHEMBL28734377 0.81 KCNMA1 (0.63) CYP1A2CYP2C19KMT2AMEN1RAB9A
SCHEMBL29721833 0.81 KCNMA1 (0.63) CYP1A2CYP2C19KMT2AMEN1RAB9A
SCHEMBL418801 0.81 SERPINE1 (0.52) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL7950901 0.80 SMN1; SMN2 (0.71) MAPK1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL5789931 0.80 MAPT (0.74) MAPK1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL10889701 0.80 MAPK1 (0.72) MAPK1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL14113119 0.78 TMPRSS4 (0.60) MAPTCYP1A2CYP3A4CYP2C9CYP2C19

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