SCHEMBL6648993

SCHEMBL6648993

Nc1ccc(N=Nc2cccc(S(=O)(=O)O)c2)cc1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 6/20 0.61
▸ SENP3 Q9H4L4 2/20 0.59
▸ SENP2 Q9HC62 2/20 0.59
▸ SENP1 Q9P0U3 2/20 0.59
▸ SUMO2 P61956 1/20 0.59
▸ SUMO1 P63165 1/20 0.59
▸ SENP7 Q9BQF6 1/20 0.59
▸ PHLPP2 Q6ZVD8 4/20 0.51
▸ ALDH1A1 P00352 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ PTGS1 P23219 1/20 0.48
▸ PTGS2 P35354 1/20 0.48
▸ CA12 O43570 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ CA9 Q16790 2/20 0.48
▸ POLB P06746 2/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ KMT2A Q03164 5/20 0.46
▸ MEN1 O00255 3/20 0.46

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
SCHEMBL4256125 0.87 PHLPP2 (0.64) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL4256120 0.87 PHLPP2 (0.64) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL13112902 0.82 PHLPP2 (0.56) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL18162857 0.82 KMT2A (0.62) GLO1PHLPP2ALDH1A1HSD17B10CYP2C9
SCHEMBL12721244 0.81 SENP3 (0.63) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL11062285 0.81 GLO1 (0.48) GLO1PHLPP2ALDH1A1HSD17B10CYP2C9
SCHEMBL9094885 0.81 SENP2 (0.63) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL9094890 0.81 SENP2 (0.63) GLO1SENP3SENP2SENP1SUMO2
SCHEMBL11062287 0.81 GLO1 (0.48) GLO1PHLPP2ALDH1A1HSD17B10CYP2C9
SCHEMBL28367923 0.80 SENP2 (0.61) GLO1SENP3SENP2SENP1SUMO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5616750-A Compounds and process SMITHKLINE BEECHAM PLC (GB) 1997-04-01 — — US claimed
EP-0655950-B1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1996-10-23 — — EP claimed
EP-0655950-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY. SMITHKLINE BEECHAM PLC (GB) 1995-06-07 — — EP claimed
WO-1994003271-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1994-02-17 — — WO claimed
US-6749674-B2 USEFUL IN RECORDING FLUIDS ESPECIALLY INK JET PRINTING PROCESSES, AND ALSO AS COLORANTS FOR ELECTROPHOTOGRAPHIC TONERS, POWDER COATINGS AND COLOR FILTERS; IMPROVED SOLUBILITY, COLORFASTNESS AND STORAGE STABILITY CLARIANT GMBH (DE) 2004-06-15 — — US disclosed
EP-0741731-B1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS SMITHKLINE BEECHAM PLC (GB) 2004-04-07 — — EP disclosed
US-20010027734-A1 Black trisazo metal complex dyes CLARIANT GMBH 2001-10-11 — — US disclosed
US-6211107-B1 Process for expoxidizing prochiral olefins and a catalyst therefor and intermediates for making the catalyst SMITHKLINE BEECHAM P.L.C. (GB) 2001-04-03 — — US disclosed
US-5916975-A Process for epoxidising prochiral olefins and a catalyst therefor and intermediates for making the catalyst SMITHKLINE BEECHAM P.L.C. (GB) 1999-06-29 — — US disclosed
US-5616750-A Compounds and process SMITHKLINE BEECHAM PLC (GB) 1997-04-01 — — US disclosed
EP-0741731-A1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST SMITHKLINE BEECHAM PLC (GB) 1996-11-13 — — EP disclosed
EP-0655950-B1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1996-10-23 — — EP disclosed
WO-1995021172-A1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST SMITHKLINE BEECHAM P.L.C. (GB) 1995-08-10 — — WO disclosed
EP-0655950-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY. SMITHKLINE BEECHAM PLC (GB) 1995-06-07 — — EP disclosed
WO-1994003271-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1994-02-17 — — WO disclosed
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