SCHEMBL9018320

SCHEMBL9018320

COC(=O)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(Oc3cccc(C(F)(F)F)c3)cc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.49
▸ MCL1 Q07820 6/20 0.48
▸ BCL2L1 Q07817 5/20 0.48
▸ GAA P10253 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ P4HTM Q9NXG6 1/20 0.45
▸ MMP2 P08253 1/20 0.43
▸ MMP3 P08254 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP8 P22894 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ MMP14 P50281 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SCN9A Q15858 1/20 0.43
▸ LIPE Q05469 2/20 0.43
▸ RAF1 P04049 1/20 0.43

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
SCHEMBL9018323 0.91 RAB9A (0.50) RAB9AMCL1BCL2L1GAAMAPT
SCHEMBL9018106 0.87 MCL1 (0.59) MCL1BCL2L1P4HTMMMP2MMP13
SCHEMBL7870464 0.85 BCL2L1 (0.45) RAB9AMCL1BCL2L1GAAMAPT
SCHEMBL9516252 0.83 BCL2L1 (0.50) RAB9AMCL1BCL2L1GAAP4HTM
SCHEMBL7871631 0.82 P4HTM (0.52) P4HTMMMP2MMP9MMP14LMNA
SCHEMBL8868192 0.82 P4HTM (0.49) RAB9AMCL1BCL2L1GAAMAPT
SCHEMBL9143139 0.81 P4HTM (0.48) RAB9AMCL1BCL2L1P4HTMMMP2
SCHEMBL9017985 0.80 P4HTM (0.66) TDP1P4HTMMMP2MMP9MMP8
SCHEMBL8868123 0.80 BCL2L1 (0.49) MCL1BCL2L1MAPTP4HTMMMP2
SCHEMBL9018452 0.79 MCL1 (0.55) MCL1BCL2L1P4HTMMMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0590520-B1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AG (DE) 1996-06-12 — — EP disclosed
EP-0590520-A1 Acylsulphonamido and sulphonamidopyridine-2-carboxylic acid esters, pyridine-n-oxides thereof, a process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-06 — — EP disclosed
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