SCHEMBL9932260

SCHEMBL9932260

NC(=O)c1ccc(F)c(NC(=O)Nc2ncnc3[nH]c(C(F)(F)F)nc23)c1F

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
BRAF P15056 2/20 0.37
AKT1 P31749 4/20 0.34
AURKA O14965 11/20 0.33
RPS6KB1 P23443 11/20 0.33
AURKB Q96GD4 3/20 0.33
PDPK1 O15530 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 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
SCHEMBL9932270 0.88 BRAF (0.38) PARP1BRAFKDM4EHPGD
SCHEMBL9932430 0.85 BRAF (0.38) BRAFAKT1AURKARPS6KB1AURKB
SCHEMBL9932544 0.80 BRAF (0.39) PARP1BRAFAKT1AURKARPS6KB1
SCHEMBL9932401 0.79 BRAF (0.41) BRAFAKT1AURKARPS6KB1AURKB
SCHEMBL9971077 0.78 BRAF (0.65) BRAF
SCHEMBL9933084 0.76 BRAF (0.38) BRAFAKT1AURKARPS6KB1AURKB
SCHEMBL9931498 0.75 BRAF (0.46) BRAFAURKB
SCHEMBL9932324 0.74 BRAF (0.61) BRAFPDPK1
SCHEMBL9932910 0.73 BRAF (0.47) BRAFAKT1AURKARPS6KB1AURKB
SCHEMBL9932437 0.72 BRAF (0.39) 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 PARP1 2993/4885BRAF 1/4885AKT1 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.