SCHEMBL5448231

SCHEMBL5448231

CC(C)(C)OC(=O)Nc1cccc(Oc2cc(-c3nc(C(N)=O)co3)ncn2)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.41
RPS6KB1 P23443 3/20 0.41
MAP2K7 O14733 7/20 0.40
KDR P35968 9/20 0.38
MAPK14 Q16539 6/20 0.38
TNNI3K Q59H18 6/20 0.38
BRAF P15056 5/20 0.38
MAP4K4 O95819 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
SCHEMBL5318628 0.88 KDR (0.45) MAP2K7KDRMAPK14TNNI3KBRAF
SCHEMBL5333814 0.87 MAP2K7 (0.42) MAP2K7KDRMAPK14TNNI3KBRAF
SCHEMBL14447589 0.84 KDR (0.39) AURKARPS6KB1KDRMAPK14TNNI3K
SCHEMBL5318656 0.84 MAP2K7 (0.47) AURKARPS6KB1MAP2K7KDRMAPK14
SCHEMBL14447617 0.82 MAP2K7 (0.43) MAP2K7KDRMAPK14TNNI3KBRAF
SCHEMBL5445955 0.82 MAP2K7 (0.44) AURKARPS6KB1MAP2K7KDRMAPK14
SCHEMBL14447622 0.81 MAP2K7 (0.46) MAP2K7KDRMAPK14TNNI3KBRAF
SCHEMBL5339167 0.80 ALDH1A1 (0.42) MAP2K7KDRMAPK14TNNI3KBRAF
SCHEMBL5375763 0.80 KDR (0.59) KDRBRAF
SCHEMBL14447578 0.79 MAP2K7 (0.46) MAP2K7KDRMAPK14TNNI3KBRAF

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 2 patents. 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
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 AURKA 921/4885RPS6KB1 759/4885MAP2K7 141/4885

“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.