SCHEMBL2192663

SCHEMBL2192663

O=S(=O)(Nc1cccc(C(O)=Cc2ccnc(Cl)n2)c1Cl)c1cc(F)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.42
CYP3A4 P08684 3/20 0.42
SLC40A1 Q9NP59 3/20 0.40
PTK2B Q14289 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 1/20 0.39
BRAF P15056 7/20 0.38
AXL P30530 1/20 0.37
NR1I2 O75469 3/20 0.37
ACLY P53396 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36

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
SCHEMBL18636304 1.00 ERN1 (0.42) ERN1CYP3A4SLC40A1PTK2BSMN1; SMN2
SCHEMBL2192658 1.00 ERN1 (0.42) ERN1CYP3A4SLC40A1PTK2BSMN1; SMN2
SCHEMBL2193244 0.85 SLC40A1 (0.46) ERN1SLC40A1BRAFNR1I2
SCHEMBL2193238 0.85 SLC40A1 (0.46) ERN1SLC40A1BRAFNR1I2
SCHEMBL18636518 0.85 SLC40A1 (0.46) ERN1SLC40A1BRAFNR1I2
SCHEMBL2193968 0.82 LMNA (0.44) PTK2BSMN1; SMN2BRAFPIK3C3
SCHEMBL2193965 0.82 LMNA (0.44) PTK2BSMN1; SMN2BRAFPIK3C3
SCHEMBL3883018 0.75 GPR35 (0.37)
SCHEMBL3883014 0.75 GPR35 (0.37)
SCHEMBL1127359 0.74 CYP3A4 (0.49) ERN1CYP3A4SLC40A1PTK2BSMN1; SMN2

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 11 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
US-20090298815-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds NOVARTIS AG (CH) 2009-12-03 US 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 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885
US-20170073341-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885
US-20160068523-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885
US-20140080851-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885
US-20130144055-A1 Benzene Sulfonamide Thiazole And Oxazole Compounds STS, TST, TPST2 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885
US-20090298815-A1 Benzene Sulfonamide Thiazole and Oxazole Compounds STS, TST, TPST2 ERN1 3675/4885CYP3A4 25/4885SLC40A1 3787/4885

“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.