SCHEMBL3589391

SCHEMBL3589391

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1nn(C)cc1-c1cc(NC2CC2)ncn1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.59
SRC P12931 3/20 0.59
LCK P06239 3/20 0.59
INSR P06213 2/20 0.59
LYN P07948 2/20 0.59
HCK P08631 1/20 0.59
TEK Q02763 1/20 0.57
BRAF P15056 13/20 0.53
CSF1R P07333 1/20 0.53
KIT P10721 1/20 0.53
BTK Q06187 1/20 0.53
RAF1 P04049 1/20 0.52
ABL1 P00519 1/20 0.52
MAPK14 Q16539 1/20 0.51

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
SCHEMBL9967392 0.90 KDR (0.47) KDRSRCLCKINSRLYN
SCHEMBL3824880 0.88 KDR (0.74) KDRSRCLCKINSRLYN
SCHEMBL3823481 0.87 KDR (0.64) KDRSRCLCKINSRLYN
SCHEMBL9970896 0.87 KDR (0.60) KDRLCKTEKBRAFCSF1R
SCHEMBL3589285 0.87 BRAF (0.60) KDRSRCLCKINSRLYN
SCHEMBL3593395 0.86 KDR (0.59) KDRSRCLCKINSRLYN
SCHEMBL3579296 0.86 KDR (0.59) KDRSRCLCKINSRLYN
SCHEMBL3823342 0.85 LCK (0.65) KDRSRCLCKINSRLYN
SCHEMBL3596597 0.85 KDR (0.66) KDRSRCLCKINSRLYN
SCHEMBL3590447 0.84 KDR (0.57) KDRLCKTEKBRAFCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US claimed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US claimed
EP-2057146-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-05-13 EP claimed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 WO claimed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
EP-2057146-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-05-13 EP disclosed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 WO disclosed
WO-2008042639-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-04-10 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK KDR 13/4885SRC 6/4885LCK 3/4885

“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.