SCHEMBL15463594

SCHEMBL15463594

COc1cc2ncnc(Oc3cccc(-c4ccc(C(C)(C)C)cc4)c3)c2cc1OC

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.66
RAF1 P04049 5/20 0.66
KDR P35968 7/20 0.66
RET P07949 1/20 0.66
KIF5B P33176 1/20 0.66
EGFR P00533 3/20 0.63
LCK P06239 2/20 0.63
CSF1R P07333 1/20 0.53
PDGFRB P09619 1/20 0.53
FLT4 P35916 1/20 0.53
FLT3 P36888 1/20 0.53

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
SCHEMBL15463770 0.92 BRAF (0.68) BRAFRAF1KDRRETKIF5B
SCHEMBL15463614 0.87 KDR (0.73) BRAFRAF1KDRRETKIF5B
SCHEMBL15463602 0.83 EGFR (0.71) BRAFRAF1KDRRETKIF5B
SCHEMBL15463615 0.83 KDR (0.61) BRAFRAF1KDRRETKIF5B
SCHEMBL15463648 0.83 BRAF (0.70) BRAFRAF1KDRRETKIF5B
SCHEMBL1015284 0.80 BRAF (1.00) BRAFRAF1KDR
SCHEMBL4471428 0.80 FGFR2 (0.70) BRAFRAF1KDREGFRLCK
SCHEMBL20229657 0.78 KDR (0.74) BRAFRAF1KDRRETKIF5B
SCHEMBL13680204 0.78 KDR (0.73) BRAFRAF1KDRRETKIF5B
SCHEMBL7485859 0.78 FGFR2 (0.71) BRAFRAF1KDRRETKIF5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8969587-B2 RAF kinase modulator compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2015-03-03 US disclosed
US-20140045868-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2014-02-13 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-20140045868-A1 RAF KINASE MODULATOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885KDR 982/4885

“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.