SCHEMBL14468720

SCHEMBL14468720

CC1CC(NC(=O)Nc2ccc(Oc3ccnc(-c4cnn(C)c4)n3)cc2)=NO1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.43
CLK2 P49760 1/20 0.40
LRRK2 Q5S007 1/20 0.40
AURKB Q96GD4 4/20 0.40
AURKA O14965 2/20 0.40
CCNK O75909 1/20 0.38
CDK12 Q9NYV4 1/20 0.38
CSF1R P07333 1/20 0.37
NTRK1 P04629 1/20 0.37
CDK1 P06493 1/20 0.37
CDK2 P24941 1/20 0.37
CDK8 P49336 1/20 0.37

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
SCHEMBL5333938 0.81 KDR (0.54) KDRAURKBAURKANTRK1CDK1
SCHEMBL5339174 0.80 SMN1; SMN2 (0.51) KDRAURKBAURKACSF1RNTRK1
SCHEMBL5345816 0.77 KDR (0.65) KDRAURKBAURKACSF1RNTRK1
SCHEMBL5429189 0.76 KDR (0.73) KDRAURKBAURKACSF1RNTRK1
SCHEMBL5454230 0.75 NTRK1 (0.56) KDRAURKBCSF1RNTRK1
SCHEMBL5457893 0.73 NTRK1 (0.63) KDRAURKBAURKACSF1RNTRK1
SCHEMBL5338760 0.72 NTRK1 (0.66) KDRAURKBAURKACSF1RNTRK1
SCHEMBL23900656 0.72 MTOR (0.42) KDRCLK2LRRK2AURKBAURKA
SCHEMBL5425879 0.71 CCNC (0.43) KDRCLK2LRRK2AURKBAURKA
SCHEMBL5442522 0.71 NTRK1 (0.58) KDRCSF1RNTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155764-A1 NOVEL SUBSTITUTED PYRIMIDINYLOXY UREAS USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 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-20070155764-A1 NOVEL SUBSTITUTED PYRIMIDINYLOXY UREAS USEFUL AS INHIBITORS OF PROTEIN KINASES BRAF, ARAF, RAF1 KDR 555/4885CLK2 989/4885LRRK2 941/4885

“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.