SCHEMBL8639192

SCHEMBL8639192

O=S(=O)(Nn1nc(F)cc1-c1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 3/20 0.43
KDM1A O60341 1/20 0.41
NAT1 P18440 1/20 0.40
KAT6A Q92794 1/20 0.39
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
MAPT P10636 2/20 0.38
MAPK9 P45984 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ERBB2 P04626 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8639275 0.87 MALT1 (0.44) MALT1KDM1ANAT1KAT6APTGES
SCHEMBL8421776 0.86 KDM1A (0.47) MALT1KDM1ANAT1KAT6AMAPT
SCHEMBL8420731 0.85 KDM1A (0.43) MALT1KDM1AMAPTPOLBPTGS2
SCHEMBL8422266 0.85 KDM1A (0.43) MALT1KDM1AMAPTPOLBPTGS2
SCHEMBL8639795 0.85 PTGS2 (0.50) MALT1PTGS1PTGS2
SCHEMBL8641119 0.85 AURKA (0.46) MALT1KDM1AKAT6AMAPTPTGS1
SCHEMBL8638127 0.85 MALT1 (0.43) MALT1KDM1ANAT1KAT6APTGES
SCHEMBL8422378 0.84 KDM1A (0.40) MALT1KDM1ANAT1KAT6APTGES
SCHEMBL8420739 0.84 MALT1 (0.40) MALT1KDM1ANAT1KAT6APTGES
SCHEMBL8643853 0.84 PTGS2 (0.41) MALT1KDM1ANAT1KAT6APTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US disclosed
US-5756529-A ANTIINFLAMMATORY G.D. SEARLE & CO. (US) 1998-05-26 US disclosed
US-5753688-A ANTIINFLAMMATORY TALLEY JOHN J (US) 1998-05-19 US disclosed
US-5510496-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1996-04-23 US disclosed
US-5504215-A Substituted pyrazolyl benzenesulfonamide compounds for the treatment of inflammation G. D. SEARLE & CO. (US) 1996-04-02 US disclosed