SCHEMBL3024889

SCHEMBL3024889

CNc1cc(-n2ncnc2Nc2cc(NC(=O)c3cccc(OC(C)C)c3)ccc2C)ncn1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.47
LCK P06239 15/20 0.47
LYN P07948 14/20 0.47
KDR P35968 14/20 0.47
SRC P12931 13/20 0.47
INSR P06213 12/20 0.47
HCK P08631 10/20 0.47
MAPK14 Q16539 1/20 0.45
SMO Q99835 1/20 0.45
TEK Q02763 1/20 0.42

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
SCHEMBL3021171 0.90 KDR (0.49) BRAFLCKLYNKDRSRC
SCHEMBL3020035 0.86 LCK (0.59) BRAFLCKLYNKDRSRC
SCHEMBL3015708 0.86 LCK (0.51) BRAFLCKLYNKDRSRC
SCHEMBL3022247 0.85 LCK (0.53) BRAFLCKLYNKDRSRC
SCHEMBL3021009 0.84 BRAF (0.59) BRAF
SCHEMBL3016002 0.82 LMNA (0.48) BRAFLCKLYNKDRSRC
SCHEMBL3021604 0.82 LCK (0.57) BRAFLCKLYNKDRSRC
SCHEMBL3020484 0.82 LCK (0.48) BRAFLCKLYNKDRSRC
SCHEMBL3021652 0.81 POLB (0.59) BRAFLCKLYNKDRSRC
SCHEMBL3020220 0.81 MAPK14 (0.47) BRAFLCKLYNKDRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US claimed
EP-2170867-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2010-04-07 EP claimed
WO-2008157131-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-12-24 WO claimed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
EP-2170867-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2010-04-07 EP disclosed
WO-2008157131-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-12-24 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-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof BMX, FRK, FYN BRAF 33/4885LCK 8/4885LYN 5/4885

“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.