SCHEMBL3589999

SCHEMBL3589999

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1ccnn1-c1cc(N)ncn1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.66
LCK P06239 4/20 0.66
LYN P07948 3/20 0.66
INSR P06213 2/20 0.66
HCK P08631 2/20 0.66
SRC P12931 2/20 0.66
CSF1R P07333 2/20 0.57
KIT P10721 1/20 0.57
BRAF P15056 14/20 0.56
RAF1 P04049 2/20 0.53
PDGFRB P09619 1/20 0.53
PDGFRA P16234 1/20 0.53
TEK Q02763 1/20 0.53

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
SCHEMBL3592667 0.90 KDR (0.55) KDRLCKLYNINSRHCK
SCHEMBL3582585 0.89 KDR (0.67) KDRLCKLYNINSRHCK
SCHEMBL9967409 0.89 LCK (0.64) KDRLCKLYNINSRHCK
SCHEMBL3579415 0.86 SRC (0.65) KDRLCKLYNINSRHCK
SCHEMBL27762680 0.85 CSF1R (0.57) KDRLCKLYNINSRHCK
SCHEMBL3591946 0.85 LMNA (0.49) KDRLCKLYNINSRHCK
Cyclopropanecarboxylic Acid Amide SCHEMBL27762878 0.85 LCK (0.53) KDRLCKLYNINSRHCK
SCHEMBL3591439 0.84 LCK (0.49) KDRLCKLYNINSRHCK
SCHEMBL3584653 0.84 LCK (0.60) KDRLCKLYNINSRHCK
SCHEMBL3588215 0.82 LCK (0.47) KDRLCKLYNINSRHCK

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 13/4885LCK 3/4885LYN 12/4885

“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.