SCHEMBL1127297

SCHEMBL1127297

O=S(=O)(Nc1cccc(-c2nc(C3CCOCC3)sc2-c2ccnc(Cl)n2)c1Cl)c1ccoc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.43
NR1I2 O75469 7/20 0.43
EGFR P00533 3/20 0.35
PLK4 O00444 1/20 0.33
EPHB6 O15197 1/20 0.33
RIPK2 O43353 1/20 0.33
JAK2 O60674 1/20 0.33
ULK1 O75385 1/20 0.33
ERN1 O75460 1/20 0.33
PRKD3 O94806 1/20 0.33
ABL1 P00519 1/20 0.33
KRAS P01116 1/20 0.33
RAF1 P04049 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CDK1 P06493 1/20 0.33
YES1 P07947 1/20 0.33
LYN P07948 1/20 0.33
MET P08581 1/20 0.33
HCK P08631 1/20 0.33

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
SCHEMBL1127537 0.93 BRAF (0.49) BRAFNR1I2PLK4EPHB6RIPK2
SCHEMBL1127330 0.92 BRAF (0.51) BRAFNR1I2EGFRPLK4EPHB6
SCHEMBL2191856 0.86 BRAF (0.53) BRAFNR1I2PLK4EPHB6RIPK2
SCHEMBL1127506 0.85 RIPK2 (0.42) BRAFNR1I2EGFRPLK4EPHB6
SCHEMBL2195448 0.84 BRAF (0.61) BRAFNR1I2EGFRPLK4EPHB6
SCHEMBL1126751 0.84 BRAF (0.59) BRAFNR1I2PLK4EPHB6RIPK2
SCHEMBL2193461 0.84 BRAF (0.49) BRAFNR1I2EGFRPLK4EPHB6
SCHEMBL1870084 0.83 BRAF (0.44) BRAFNR1I2EGFR
SCHEMBL1127554 0.82 BRAF (0.51) BRAFNR1I2PLK4EPHB6RIPK2
SCHEMBL2195593 0.82 NR1I2 (0.49) BRAFNR1I2EGFRPLK4EPHB6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170073341-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds NOVARTIS AG (CH) 2017-03-16 US disclosed
EP-3106462-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS Novartis AG (CH) 2016-12-21 EP disclosed
US-20160068523-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds NOVARTIS AG (CH) 2016-03-10 US disclosed
US-9233956-B2 Benzene sulfonamide thiazole and oxazole compounds NOVARTIS AG (CH) 2016-01-12 US disclosed
US-20140080851-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds GLAXOSMITHKLINE LLC (US) 2014-03-20 US disclosed
US-8642759-B2 Benzene sulfonamide thiazole and oxazole compounds GLAXOSMITHKLINE LLC (US) 2014-02-04 US disclosed
US-20130144055-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds GLAXOSMITHKLINE LLC (US) 2013-06-06 US disclosed
US-8415345-B2 Benzene sulfonamide thiazole and oxazole compounds Glaxo SmithKline LLC (US) 2013-04-09 US disclosed
US-7994185-B2 Benzene sulfonamide thiazole and oxazole compounds Glaxo Smith Kline LLC (US) 2011-08-09 US disclosed
US-20110172215-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds NOVARTIS AG (CH) 2011-07-14 US disclosed
EP-2282636-A2 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2011-02-16 EP disclosed
US-20090298815-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds NOVARTIS AG (CH) 2009-12-03 US disclosed
WO-2009137391-A2 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-11-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110172215-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885
US-20170073341-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885
US-20160068523-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885
US-20140080851-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885
US-20130144055-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885
US-20090298815-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 BRAF 776/4885NR1I2 886/4885EGFR 2172/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.