SCHEMBL15031023

SCHEMBL15031023

CON(C)C(=O)c1cc(C)cc(S(F)(F)(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.43
CLK1 P49759 1/20 0.35
DYRK1A Q13627 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
ABCB1 P08183 1/20 0.33
TPMT P51580 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
SLC7A5 Q01650 1/20 0.32
ICAM1 P05362 1/20 0.30
SELE P16581 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
SCHEMBL1188757 0.84 MLYCD (0.43) MLYCDCLK1DYRK1ADYRK1BTRPM8
SCHEMBL1194431 0.83 MLYCD (0.42) MLYCDCLK1DYRK1ADYRK1BTRPM8
SCHEMBL1193980 0.83 MLYCD (0.42) MLYCDCLK1DYRK1ADYRK1BTRPM8
SCHEMBL1169591 0.83 MLYCD (0.42) MLYCDCLK1DYRK1ADYRK1BTRPM8
SCHEMBL4719735 0.83 TPMT (0.46) MLYCDCLK1DYRK1ADYRK1BABCB1
SCHEMBL6493529 0.83 MLYCD (0.45) MLYCDCLK1DYRK1ADYRK1BABCB1
SCHEMBL13746764 0.80 MLYCD (0.40) MLYCDCLK1DYRK1ADYRK1BTRPM8
SCHEMBL3716405 0.79 MLYCD (0.43) MLYCDCLK1DYRK1ADYRK1BABCB1
SCHEMBL1194738 0.79 MLYCD (0.39) MLYCDCLK1DYRK1ADYRK1BABCB1
SCHEMBL1169078 0.79 ATM (0.47) MLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2240179-B1 IMIDAZOPYRIDAZINE AS PAR1 INHIBITORS, THEIR MANUFACTURE AND THEIR APPLICATION AS MEDICINE SANOFI SA (FR) 2016-08-17 EP disclosed
US-9079906-B2 Triazolopyridazines as PAR1 inhibitors, production thereof, and use as medicaments SANOFI (FR) 2015-07-14 US disclosed
US-8853206-B2 Triazolium salts as PAR1 inhibitors, production thereof, and use as medicaments SANOFI (FR) 2014-10-07 US disclosed
US-8466169-B2 SF5 derivatives as PAR1 inhibitors, production thereof, and use as medicaments SANOFI (FR) 2013-06-18 US disclosed