SCHEMBL1462073

SCHEMBL1462073

CC(C)CS(=O)(=O)Nc1ccc(Cl)c(N)c1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
CYP2C9 P11712 3/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
BRAF P15056 8/20 0.39
PTGES2 Q9H7Z7 2/20 0.37
CYP2C19 P33261 1/20 0.36
BRD4 O60885 2/20 0.35
KMT2A Q03164 1/20 0.35
PSIP1 O75475 1/20 0.33
SLC22A12 Q96S37 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
SCHEMBL1492048 0.87 CYP2C9 (0.48) MAPTCYP2C9CYP3A4ALOX5APFEN1
SCHEMBL1437245 0.85 PSIP1 (0.47) CYP2C9CYP3A4BRAFPTGES2CYP2C19
SCHEMBL9930639 0.81 CYP2C9 (0.48) MAPTCYP2C9CYP3A4ALOX5APFEN1
SCHEMBL1462080 0.81 CYP3A4 (0.56) CYP2C9CYP3A4BRAFCYP2C19
SCHEMBL9930938 0.80 BRAF (0.47) MAPTCYP2C9CYP3A4ALOX5APFEN1
SCHEMBL1462058 0.80 CYP2C9 (0.46) MAPTCYP2C9CYP3A4BRAFKMT2A
SCHEMBL1462087 0.77 BRAF (0.49) CYP2C9CYP3A4BRAFPTGES2CYP2C19
SCHEMBL19221593 0.77 MAPT (0.46) MAPTCYP3A4ALOX5APFEN1PTGES2
SCHEMBL1818143 0.72 CYP2C9 (0.68) MAPTCYP2C9CYP3A4ALOX5APFEN1
SCHEMBL9930367 0.72 CYP2C9 (0.57) MAPTCYP2C9CYP3A4ALOX5APFEN1

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-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2013-01-17 US claimed
US-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2013-01-17 US disclosed
US-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2013-01-17 US disclosed
US-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2013-01-17 US disclosed
CN-102712646-A RAF inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC 2012-10-03 CN disclosed
WO-2012118492-A1 HETEROCYCLIC SULFONAMIDES AS RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-09-07 WO disclosed
EP-2493865-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2012-09-05 EP disclosed
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
WO-2011025938-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
WO-2011025938-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
WO-2011025940-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 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 (2 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-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPT 1082/4885CYP2C9 2926/4885CYP3A4 2785/4885
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF MAPT 1082/4885CYP2C9 2926/4885CYP3A4 2785/4885

“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.