SCHEMBL12856388

SCHEMBL12856388

Oc1cc(-c2[nH]c(-c3ccccc3)nc2-c2ccncc2)ccc1Cl

nearest known ligand 0.90

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.90
RAF1 P04049 10/20 0.90
MAPK13 O15264 12/20 0.73
MAPK12 P53778 12/20 0.73
MAPK11 Q15759 12/20 0.73
MAPK14 Q16539 12/20 0.73
GCGR P47871 3/20 0.68
MAPK9 P45984 1/20 0.68
BRDT Q58F21 1/20 0.63
ALOX5 P09917 1/20 0.62

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
SCHEMBL7643418 0.95 BRAF (1.00) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL29355176 0.95 BRAF (1.00) BRAFRAF1MAPK13MAPK12MAPK11
Bromide SCHEMBL7648283 0.93 BRAF (0.95) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL7648286 0.90 BRAF (0.91) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL15075633 0.89 BRAF (0.91) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL14689935 0.85 RAF1 (0.67) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL2649589 0.84 MAPK13 (0.90) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL28403334 0.84 MAPK13 (1.00) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL6469877 0.82 MAPK14 (1.00) BRAFRAF1MAPK13MAPK12MAPK11
SCHEMBL5921859 0.82 MAPK13 (1.00) BRAFRAF1MAPK13MAPK12MAPK11

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-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED (GB) 2016-12-08 US disclosed
EP-1364212-B1 THREE HYBRID ASSAY SYSTEM GPC BIOTECH AG (DE) 2011-02-02 EP disclosed
EP-1975620-A2 Three hybrid assay system GPC Biotech AG (DE) 2008-10-01 EP 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-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1D BRAF 2682/4885RAF1 737/4885MAPK13 715/4885

“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.