SCHEMBL8487135

SCHEMBL8487135

CS(=O)(=O)c1ccc(-c2cc(C(N)=O)nn2Cc2ccc(F)cc2F)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.48
NR1H2 P55055 1/20 0.48
NR1H3 Q13133 1/20 0.48
PTGS2 P35354 10/20 0.42
KCNK3 O14649 2/20 0.42
AOC3 Q16853 1/20 0.41
PTGS1 P23219 2/20 0.41
CHRNA7 P36544 2/20 0.41
KCNH2 Q12809 1/20 0.40
PTGER1 P34995 1/20 0.40

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
SCHEMBL8578621 0.80 RXRA (0.48) RXRANR1H2NR1H3PTGS2KCNK3
SCHEMBL9208779 0.80 PTGS2 (0.51) PTGS2AOC3PTGS1CHRNA7
SCHEMBL9199556 0.76 AOC3 (0.65) PTGS2AOC3PTGS1CHRNA7
SCHEMBL9202470 0.73 PTGS2 (0.51) PTGS2AOC3PTGS1CHRNA7
SCHEMBL9208216 0.72 PTGS2 (0.49) RXRANR1H2NR1H3PTGS2AOC3
SCHEMBL8491097 0.70 RXRA (0.56) RXRANR1H2NR1H3PTGS2PTGS1
SCHEMBL27330300 0.70 PTGS2 (0.55) PTGS2AOC3PTGS1CHRNA7
SCHEMBL9744795 0.70 PTGS2 (0.55) PTGS2PTGS1CHRNA7
SCHEMBL9212272 0.70 MARS1 (0.55) PTGS2AOC3PTGS1CHRNA7
SCHEMBL9744791 0.70 PTGS2 (0.46) PTGS2CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999025695-A1 5-ARYLPYRAZOLE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-05-27 WO disclosed