SCHEMBL2148588

SCHEMBL2148588

O=C(O)c1cc(-c2[nH]c(-c3ccccc3)nc2-c2ccnc(O)c2)ccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.59
RAF1 P04049 7/20 0.59
MAPK14 Q16539 11/20 0.56
MAPK13 O15264 8/20 0.56
MAPK12 P53778 8/20 0.56
MAPK11 Q15759 8/20 0.56
GCGR P47871 2/20 0.48
BRDT Q58F21 1/20 0.48
CSNK1D P48730 1/20 0.47
CSNK1E P49674 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
GSK3B P49841 1/20 0.46

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
SCHEMBL12461153 1.00 BRAF (0.59) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461199 0.87 MAPK14 (0.52) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461164 0.87 BRAF (0.48) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461180 0.87 MAPK14 (0.51) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL14689935 0.87 RAF1 (0.67) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL2148230 0.86 RAF1 (0.53) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461893 0.86 RAF1 (0.53) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461173 0.85 MAPK14 (0.48) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461163 0.85 MPO (0.53) BRAFRAF1MAPK14MAPK13MAPK12
SCHEMBL12461179 0.84 BRAF (0.64) BRAFRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130040983-A1 RAF KINASE INHIBITORS RUGA CORPORATION 2013-02-14 US disclosed
US-20130040983-A1 RAF KINASE INHIBITORS RUGA CORPORATION 2013-02-14 US disclosed
WO-2011085269-A1 RAF KINASE INHIBITORS SELEXAGEN THERAPEUTICS, INC. (US) 2011-07-14 WO 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-20130040983-A1 RAF KINASE INHIBITORS BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885MAPK14 193/4885

“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.