SCHEMBL6524714

SCHEMBL6524714

CC(N)CNc1ccnc(-c2[nH]c(-c3ccc(C(F)(F)F)cc3)nc2Br)n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 9/20 0.38
MAPK14 Q16539 3/20 0.36
MAPK13 O15264 1/20 0.36
RAF1 P04049 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
TRPV1 Q8NER1 2/20 0.34
BRAF P15056 1/20 0.33
PRKCI P41743 3/20 0.33

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
SCHEMBL6524709 1.00 TRPV3 (0.38) TRPV3MAPK14MAPK13RAF1MAPK12
SCHEMBL1494626 0.84 BRAF (0.49) TRPV3BRAF
SCHEMBL1494628 0.84 BRAF (0.49) TRPV3BRAF
SCHEMBL6519811 0.82 BRAF (0.45) TRPV3MAPK14MAPK13RAF1MAPK12
SCHEMBL6519820 0.82 BRAF (0.45) TRPV3MAPK14MAPK13RAF1MAPK12
SCHEMBL12848286 0.72 BRAF (0.43) BRAF
SCHEMBL67797 0.66 BRAF (0.54) BRAF
SCHEMBL67798 0.66 BRAF (0.54) BRAF
SCHEMBL4513006 0.65 PRKD3 (0.68) TRPV3
SCHEMBL4512994 0.65 PRKD3 (0.68) TRPV3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859548-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS AG (CH) 2014-10-14 US disclosed
EP-2470528-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2014-10-01 EP disclosed
US-20140011825-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS AG (CH) 2014-01-09 US disclosed
US-8563553-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS AG (CH) 2013-10-22 US disclosed
US-20120225899-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-09-06 US disclosed
US-8242260-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS AG (CH) 2012-08-14 US disclosed
US-20110052578-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-03-03 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 (3 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-20110052578-A1 Compounds and Compositions as Protein Kinase Inhibitors RAF1, BRAF, ARAF TRPV3 4053/4885MAPK14 344/4885MAPK13 232/4885
US-20120225899-A1 Compounds and Compositions as Protein Kinase Inhibitors RAF1, BRAF, ARAF TRPV3 4053/4885MAPK14 344/4885MAPK13 232/4885
US-20140011825-A1 Compounds and Compositions as Protein Kinase Inhibitors RAF1, BRAF, ARAF TRPV3 4053/4885MAPK14 344/4885MAPK13 232/4885

“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.