SCHEMBL9931391

SCHEMBL9931391

CCCS(=O)(=O)N(Cc1ccc(OC)cc1)c1ccc(F)c(NC(=O)c2snc3c(N)ncnc23)c1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.42
RAF1 P04049 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KMT2A Q03164 2/20 0.32
TP53 P04637 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.31
TNF P01375 1/20 0.31
NOD2 Q9HC29 1/20 0.31
NOD1 Q9Y239 1/20 0.31
CSF1R P07333 1/20 0.31

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
SCHEMBL9930497 0.90 BRAF (0.35) BRAFKMT2ATP53LMNAMAPT
SCHEMBL9930389 0.83 BRAF (0.60) BRAFRAF1CSF1R
SCHEMBL14574660 0.81 BRAF (0.48) BRAFRAF1TP53LMNAMAPT
SCHEMBL9930333 0.80 BRAF (0.49) BRAFRAF1TP53CSF1R
SCHEMBL9930834 0.80 BRAF (0.49) BRAFRAF1TP53CSF1R
SCHEMBL9930556 0.79 BRAF (0.48) BRAFRAF1TP53CSF1R
SCHEMBL9930341 0.79 BRAF (0.48) BRAFRAF1TP53CSF1R
SCHEMBL14574885 0.79 BRAF (0.38) BRAFRAF1CSF1R
SCHEMBL14574813 0.79 BRAF (0.56) BRAF
SCHEMBL9930345 0.79 BRAF (0.37) BRAFTP53LMNAMAPT

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-20120157439-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-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885TDP1 633/4885

“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.