SCHEMBL9932437

SCHEMBL9932437

Nc1ccc(F)c(NC(=O)Nc2ncnc3[nH]c(Br)nc23)c1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.39
FLT3 P36888 1/20 0.31
AKT1 P31749 1/20 0.31
EGFR P00533 4/20 0.30
FLT1 P17948 2/20 0.30
FLT4 P35916 2/20 0.30
KDR P35968 2/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
ERBB2 P04626 1/20 0.30

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
SCHEMBL9932430 0.87 BRAF (0.38) BRAFAKT1
SCHEMBL9932270 0.85 BRAF (0.38) BRAFFLT3EGFRFLT1FLT4
SCHEMBL9932549 0.81 BRAF (0.41) BRAFEGFRFLT1KDR
SCHEMBL9932406 0.80 BRAF (0.42) BRAFFLT3
SCHEMBL9967978 0.79 BRAF (0.67) BRAF
SCHEMBL9933089 0.77 BRAF (0.40) BRAFEGFR
SCHEMBL9931500 0.76 BRAF (0.47) BRAFEGFR
SCHEMBL9932327 0.75 BRAF (0.63) BRAFFLT3KDR
SCHEMBL9932914 0.74 BRAF (0.49) BRAFFLT3EGFRFLT1FLT4
SCHEMBL9932260 0.72 PARP1 (0.41) BRAFAKT1

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 263/4885AKT1 35/4885

“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.