SCHEMBL3386993

SCHEMBL3386993

COc1cc(NC(=O)c2cc(-n3cnc(C)c3)cc(C(F)(F)F)c2)cc(NC(=O)N(C)c2ncnc3[nH]ccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.53
MAP3K20 Q9NYL2 1/20 0.53
MAP4K2 Q12851 2/20 0.53
MAP3K7 O43318 1/20 0.53
BRAF P15056 4/20 0.52
RAF1 P04049 3/20 0.52
NR2E1 Q9Y466 7/20 0.51
KIT P10721 2/20 0.48
LDLR P01130 1/20 0.48
PCSK9 Q8NBP7 1/20 0.48
ABL1 P00519 3/20 0.48
PDGFRB P09619 1/20 0.48
DDR1 Q08345 1/20 0.48
NTRK3 Q16288 1/20 0.48
DDR2 Q16832 1/20 0.48
BCR P11274 2/20 0.46
EGFR P00533 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
YES1 P07947 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
SCHEMBL3388334 0.86 CSF1R (0.60) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL3389503 0.85 BRAF (0.50) MAPK14MAP4K2MAP3K7BRAFRAF1
SCHEMBL3386095 0.84 MAP4K2 (0.63) MAPK14MAP3K20MAP4K2MAP3K7RAF1
SCHEMBL4714607 0.84 MAP3K7 (0.39) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL2847430 0.81 MAP4K2 (0.58) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL14572600 0.80 BRAF (0.49) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL3390181 0.76 BRAF (0.41) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL13708186 0.75 MAPK14 (0.59) MAPK14MAP3K20MAP4K2MAP3K7BRAF
SCHEMBL4482184 0.74 NR2E1 (0.67) MAPK14MAP3K20MAP4K2MAP3K7RAF1
SCHEMBL4482180 0.74 NR2E1 (0.67) MAPK14MAP3K20MAP4K2MAP3K7NR2E1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US claimed
EP-1891066-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-22 EP claimed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US claimed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
EP-1891066-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-22 EP disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 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 (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-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors SRC, FYN, SYK MAPK14 226/4885MAP3K20 33/4885MAP4K2 17/4885

“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.