SCHEMBL9930341

SCHEMBL9930341

CCCS(=O)(=O)N(Cc1ccc(OC)cc1)c1ccc(F)c(NC(=O)c2csc3c(C(O)O)ncnc23)c1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.48
RAF1 P04049 4/20 0.38
CSF1R P07333 2/20 0.36
ERN1 O75460 2/20 0.35
CYP2C9 P11712 1/20 0.35
MMP9 P14780 4/20 0.33
MMP13 P45452 3/20 0.33
MMP1 P03956 2/20 0.33
APLNR P35414 3/20 0.33
TP53 P04637 1/20 0.32
DDR1 Q08345 1/20 0.32
DDR2 Q16832 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
SCHEMBL9930556 0.94 BRAF (0.48) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930333 0.90 BRAF (0.49) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930124 0.90 BRAF (0.48) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930834 0.90 BRAF (0.49) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930389 0.87 BRAF (0.60) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930219 0.87 BRAF (0.48) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL1492061 0.84 BRAF (0.52) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930520 0.84 BRAF (0.51) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9930676 0.82 BRAF (0.49) BRAFRAF1CSF1RERN1CYP2C9
SCHEMBL9931029 0.80 BRAF (0.47) BRAFRAF1CSF1RERN1CYP2C9

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 2/4885CSF1R 1898/4885

“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.