SCHEMBL8941703

SCHEMBL8941703

CS(=O)(=O)c1ccc(Oc2cccc(F)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CHRM5 P08912 1/20 0.41
PTGS2 P35354 4/20 0.41
PTGS1 P23219 2/20 0.41
SLC6A4 P31645 1/20 0.41
FPR2 P25090 1/20 0.40
SCN9A Q15858 1/20 0.40
P2RX3 P56373 1/20 0.38

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
SCHEMBL8941551 0.85 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL9987882 0.79 GCK (0.47) PTGS2PTGS1
SCHEMBL21330640 0.78 MEN1 (0.48) MEN1KMT2AP2RX3
SCHEMBL21330627 0.78 MEN1 (0.52) MEN1KMT2AFPR2SCN9AP2RX3
SCHEMBL8941507 0.78 MEN1 (0.50) MEN1KMT2ACHRM5FPR2SCN9A
SCHEMBL8941557 0.76 MAPT (0.56) MEN1KMT2APTGS2PTGS1
SCHEMBL8941674 0.76 F2 (0.46)
SCHEMBL11684243 0.75 HSPB1 (0.56) MEN1KMT2A
SCHEMBL21330612 0.75 MEN1 (0.51) MEN1KMT2AP2RX3
SCHEMBL11684536 0.75 MEN1 (0.47) MEN1KMT2AFPR2SCN9A

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
US-5480568-A FOR LUBRICATING METAL CONTAINING SURFACES THE DOW CHEMICAL COMPANY (US) 1996-01-02 US disclosed