SCHEMBL1825136

SCHEMBL1825136

Cc1cc(Nc2cc(-n3ccnc3Nc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)ncn2)n(C)n1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LCK P06239 16/20 0.55
KDR P35968 16/20 0.55
LYN P07948 15/20 0.55
SRC P12931 15/20 0.55
INSR P06213 13/20 0.55
HCK P08631 13/20 0.55
BRAF P15056 1/20 0.51
TEK Q02763 1/20 0.50
BTK Q06187 1/20 0.50
MAPK3 P27361 1/20 0.49
TNK2 Q07912 1/20 0.49
MAP4K2 Q12851 1/20 0.49

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
SCHEMBL3241898 0.91 KDR (0.55) LCKKDRLYNSRCINSR
SCHEMBL1827988 0.90 LCK (0.58) LCKKDRLYNSRCINSR
SCHEMBL1824307 0.90 LCK (0.59) LCKKDRLYNSRCINSR
SCHEMBL5548050 0.90 LCK (0.45) LCKKDRLYNSRCINSR
SCHEMBL1824843 0.88 KDR (0.56) LCKKDRLYNSRCINSR
SCHEMBL13269691 0.88 KDR (0.57) LCKKDRLYNSRCINSR
SCHEMBL1825232 0.88 LCK (0.56) LCKKDRLYNSRCINSR
SCHEMBL3236253 0.88 POLB (0.61) LCKKDRLYNSRCINSR
SCHEMBL1826568 0.87 LCK (0.56) LCKKDRLYNSRCINSR
SCHEMBL1826800 0.87 LCK (0.56) LCKKDRLYNSRCINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758892-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-10-17 EP claimed
JP-4688876-B2 2011-05-25 JP claimed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US claimed
US-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2007-09-27 US claimed
EP-1758892-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-03-07 EP claimed
WO-2005123719-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-12-29 WO claimed
EP-1758892-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2012-10-17 EP disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-7745437-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2010-06-29 US disclosed
US-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2007-09-27 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-20070225286-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, PTK2B, SRC LCK 49/4885KDR 311/4885LYN 81/4885

“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.