SCHEMBL4239378

SCHEMBL4239378

NC(=O)c1cccc(Nc2cc(Oc3cccc(C(F)(F)F)c3)ncn2)c1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.69
BCR P11274 3/20 0.69
KDR P35968 15/20 0.58
AURKA O14965 1/20 0.57
BRAF P15056 13/20 0.55
MAPK14 Q16539 11/20 0.55
TNNI3K Q59H18 11/20 0.55
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
GAA P10253 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
SCHEMBL4239038 0.86 AURKA (0.70) ABL1BCRAURKAKDM4EMAPT
SCHEMBL4239383 0.84 KDR (0.57) ABL1BCRKDRBRAFMAPK14
SCHEMBL12262244 0.81 MAP2K7 (0.66) KDRBRAFMAPK14TNNI3K
SCHEMBL13777941 0.81 KDR (0.81) KDRAURKABRAF
SCHEMBL12262247 0.77 KDR (0.51) ABL1BCRKDRBRAFMAPK14
SCHEMBL4234986 0.76 AURKA (0.55) ABL1BCRKDRAURKATNNI3K
SCHEMBL4244096 0.74 L3MBTL1 (0.57) KDRBRAFMAPK14TNNI3KMAPT
SCHEMBL4235267 0.74 AURKA (0.55) ABL1BCRKDRAURKATNNI3K
SCHEMBL8199722 0.74 MAPT (0.54) KDRBRAFMAPK14TNNI3KMAPT
SCHEMBL3175643 0.73 KDR (0.77) KDRBRAFMAPK14TNNI3K

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-20090181991-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC 2009-07-16 US claimed
EP-1943233-A2 COMPOUNDS AND COMPOSITIONS FOR PROTEIN KINASE INHBITORS IRM, LLC (BM) 2008-07-16 EP claimed
WO-2007056151-A2 PROTEIN KINASE INHBITORS IRM LLC (BM) 2007-05-18 WO claimed
US-20090181991-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC 2009-07-16 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-20090181991-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS ERBB2, BMX, ERBB3 ABL1 75/4885BCR 313/4885KDR 116/4885

“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.