SCHEMBL3822873

SCHEMBL3822873

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1ncncc1-c1cc(NCCCN2CCN(C)CC2)ncn1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.66
LCK P06239 10/20 0.66
INSR P06213 9/20 0.66
LYN P07948 9/20 0.66
HCK P08631 9/20 0.66
SRC P12931 9/20 0.66
BRAF P15056 9/20 0.58
TEK Q02763 1/20 0.56
MAPK14 Q16539 1/20 0.52
RAF1 P04049 2/20 0.52
ARAF P10398 2/20 0.52

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
SCHEMBL3827237 0.96 KDR (0.66) KDRLCKINSRLYNHCK
SCHEMBL3827627 0.91 KDR (0.59) KDRLCKINSRLYNHCK
SCHEMBL3821636 0.91 LCK (0.66) KDRLCKINSRLYNHCK
SCHEMBL3825078 0.90 LCK (0.60) KDRLCKINSRLYNHCK
SCHEMBL3828517 0.88 BRAF (0.65) KDRLCKINSRLYNHCK
SCHEMBL3824874 0.86 KDR (0.65) KDRLCKINSRLYNHCK
SCHEMBL3596597 0.86 KDR (0.66) KDRLCKINSRLYNHCK
SCHEMBL3823342 0.85 LCK (0.65) KDRLCKINSRLYNHCK
SCHEMBL3831133 0.84 LCK (0.59) KDRLCKINSRLYNHCK
SCHEMBL3824610 0.84 BRAF (0.59) KDRLCKINSRLYNHCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069327-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-03-12 US claimed
US-20090069327-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-03-12 US disclosed
US-20090069327-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-03-12 US disclosed
US-20090069327-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-03-12 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-20090069327-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS SRC, BMX, FYN KDR 95/4885LCK 4/4885INSR 1123/4885

“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.