SCHEMBL12461224

SCHEMBL12461224

O=C(O)c1cccc(-c2nc(-c3ccccc3)[nH]c2-c2ccnc(O)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.55
CSNK1D P48730 1/20 0.55
CSNK1E P49674 1/20 0.55
RAF1 P04049 6/20 0.55
MAPK13 O15264 5/20 0.55
MAPK12 P53778 5/20 0.55
MAPK11 Q15759 5/20 0.55
BRAF P15056 5/20 0.55
BRDT Q58F21 1/20 0.55
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 4/20 0.53
HPGD P15428 4/20 0.53
GLA P06280 3/20 0.53
GAA P10253 3/20 0.53
KMT2A Q03164 3/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TGFBR1 P36897 2/20 0.51
MEN1 O00255 2/20 0.51

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
SCHEMBL12461169 0.87 MAPK14 (0.57) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461181 0.87 TGFBR1 (0.53) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461174 0.87 MAPK14 (0.58) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL2148151 0.85 MAPK14 (0.68) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461178 0.84 BRAF (0.59) MAPK14CSNK1DCSNK1ERAF1BRAF
SCHEMBL12461201 0.84 KDM4E (0.52) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461176 0.84 BRAF (0.51) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461175 0.84 TGFBR1 (0.49) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL12461153 0.82 BRAF (0.59) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL2148588 0.82 BRAF (0.59) MAPK14CSNK1DCSNK1ERAF1MAPK13

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 MAPK14 193/4885CSNK1D 531/4885CSNK1E 269/4885

“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.