SCHEMBL9932324

SCHEMBL9932324

NC(=O)c1ccc(F)c(NC(=O)Nc2ncnc3[nH]ncc23)c1F

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.61
FLT3 P36888 9/20 0.47
PTK2 Q05397 1/20 0.44
PAK1 Q13153 3/20 0.40
MKNK1 Q9BUB5 2/20 0.40
PDPK1 O15530 1/20 0.40
MAPK1 P28482 2/20 0.40
HTT P42858 1/20 0.40
TTBK1 Q5TCY1 1/20 0.40
KDR P35968 1/20 0.38

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
SCHEMBL9932327 0.86 BRAF (0.63) BRAFFLT3PTK2PAK1MKNK1
SCHEMBL9931498 0.83 BRAF (0.46) BRAFMKNK1TTBK1
SCHEMBL9932401 0.80 BRAF (0.41) BRAFPDPK1
SCHEMBL9932670 0.79 EGFR (0.42) BRAFFLT3MAPK1KDR
SCHEMBL9932544 0.79 BRAF (0.39) BRAFMKNK1PDPK1KDR
SCHEMBL9932910 0.78 BRAF (0.47) BRAFPDPK1KDR
SCHEMBL9933084 0.77 BRAF (0.38) BRAFPDPK1
SCHEMBL9967961 0.76 BRAF (1.00) BRAF
SCHEMBL9932430 0.76 BRAF (0.38) BRAFPDPK1
SCHEMBL9932224 0.76 BRAF (0.65) BRAFPDPK1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 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 (1 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-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF BRAF 1/4885FLT3 263/4885PTK2 202/4885

“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.