SCHEMBL10129554

SCHEMBL10129554

CC(C)S(=O)(=O)Nc1ccc(F)c(N)c1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.44
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
BRAF P15056 4/20 0.40
CYP2C9 P11712 4/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 1/20 0.38
GRIA4 P48058 4/20 0.34
NR3C1 P04150 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.33
CYP2D6 P10635 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
PSIP1 O75475 1/20 0.32

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
SCHEMBL1492048 0.82 CYP2C9 (0.48) ALOX5APFEN1BRAFCYP2C9CYP3A4
SCHEMBL14964633 0.80 KDM1A (0.42) ALOX5APFEN1CYP2C9CYP3A4CYP2C19
SCHEMBL413622 0.80 CYP2C9 (0.60) ACLYALOX5APFEN1BRAFCYP2C9
SCHEMBL26401647 0.80 CYP2C9 (0.42) ACLYBRAFCYP2C9CYP3A4CYP2C19
SCHEMBL25111331 0.79 ACLY (0.41) ACLYALOX5APFEN1BRAFCYP2C9
SCHEMBL1437637 0.77 PSIP1 (0.56) ALOX5APFEN1BRAFCYP2C9CYP3A4
SCHEMBL1492041 0.76 POLB (0.42) ALOX5APFEN1BRAFCYP2C9CYP3A4
SCHEMBL3017382 0.75 CYP2C19 (0.52) CYP2C9CYP2C19CYP2D6
SCHEMBL14964586 0.75 CYP3A4 (0.47) BRAFCYP2C9CYP3A4CYP2C19PTGES2
SCHEMBL14317780 0.74 ACLY (0.39) ACLYALOX5APFEN1BRAFCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2647637-B1 PURINYLPYRIDINYLAMINO-2,4-DIFLUOROPHENYL SULFONAMIDE DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION WITH INHIBITORY ACTIVITY AGAINST RAF KINASE, CONTAINING SAME AS ACTIVE INGREDIENT MEDPACTO INC (KR) 2016-02-03 EP disclosed
US-9216981-B2 Purinylpyridinylamino-2,4-difluorophenyl sulfonamide derivative, pharmaceutically acceptable salt thereof, preparation method thereof, and pharmaceutical composition with inhibitory activity against Raf kinase, containing same as active ingredient MEDPACTO, INC. (KR) 2015-12-22 US disclosed
US-8710055-B2 Triazolylphenyl sulfonamides as serine/threonine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-04-29 US disclosed
US-20130317023-A1 NOVEL PURINYLPYRIDINYLAMINO-2,4-DIFLUOROPHENYL SULFONAMIDE DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION WITH INHIBITORY ACTIVITY AGAINST RAF KINASE, CONTAINING SAME AS ACTIVE INGREDIENT YOUAI CO., LTD. (KR) 2013-11-28 US disclosed
EP-2647637-A2 NOVEL PURINYLPYRIDINYLAMINO-2,4-DIFLUOROPHENYL SULFONAMIDE DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION WITH INHIBITORY ACTIVITY AGAINST RAF KINASE, CONTAINING SAME AS ACTIVE INGREDIENT Youai Co., Ltd. (KR) 2013-10-09 EP disclosed
US-20130023531-A1 PYRIMIDO[5,4-D]PYRIMIDYLAMINO PHENYL SULFONAMIDES AS SERINE/THREONINE KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-01-24 US disclosed
US-20120322803-A1 Triazolylphenyl sulfonamides as serine/threonine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-20 US disclosed
WO-2012085127-A1 NEW TRIAZOLYLPHENYL SULFONAMIDES AS SERINE/THREONINE KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-28 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 (3 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-20120322803-A1 Triazolylphenyl sulfonamides as serine/threonine kinase inhibitors CDK2, TNNI3K, CDK1 ACLY 1836/4885ALOX5AP 4844/4885FEN1 4344/4885
US-20130317023-A1 NOVEL PURINYLPYRIDINYLAMINO-2,4-DIFLUOROPHENYL SULFONAMIDE DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION WITH INHIBITORY ACTIVITY AGAINST RAF KINASE, CONTAINING SAME AS ACTIVE INGREDIENT BRAF, RAF1, ARAF ACLY 4723/4885ALOX5AP 2439/4885FEN1 3929/4885
US-20130023531-A1 PYRIMIDO[5,4-D]PYRIMIDYLAMINO PHENYL SULFONAMIDES AS SERINE/THREONINE KINASE INHIBITORS CDK2, CDK4, CCNI ACLY 3120/4885ALOX5AP 3735/4885FEN1 3082/4885

“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.