SCHEMBL8630337

SCHEMBL8630337

Cc1ccc(-c2cn(C)nc2-c2ccccc2S(N)(=O)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.46
F2 P00734 2/20 0.46
PRSS1 P07477 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA12 O43570 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CA1 P00915 1/20 0.40
MAPK14 Q16539 2/20 0.39
TGFBR1 P36897 1/20 0.39
MAPK13 O15264 1/20 0.39
CSNK1D P48730 1/20 0.39
CSNK1E P49674 1/20 0.39

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
SCHEMBL8628190 0.90 F10 (0.48) F10F2PRSS1PRSS2PRSS3
SCHEMBL8633277 0.89 PTGS2 (0.50) F10F2PRSS1PRSS2PRSS3
SCHEMBL8631026 0.88 CSNK1D (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL8629361 0.86 TGFBR1 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL8634611 0.83 F10 (0.40) F10F2PRSS1PRSS2PRSS3
SCHEMBL8634904 0.83 ALOX5AP (0.47) F10F2PRSS1PRSS2PRSS3
SCHEMBL8631646 0.83 SMN1; SMN2 (0.54) F10F2PRSS1PRSS2PRSS3
SCHEMBL8634888 0.83 F10 (0.43) F10F2PRSS1PRSS2PRSS3
SCHEMBL8630126 0.81 F10 (0.39) F10ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL8628225 0.81 F10 (0.41) F10F2PRSS1PRSS2PRSS3

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-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed