SCHEMBL5449157

SCHEMBL5449157

CN(C)/C=C/C(=O)c1cc(Oc2cccc(NC(=O)OC(C)(C)C)c2)ncn1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K7 O14733 14/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
KDR P35968 4/20 0.39
BRAF P15056 2/20 0.39
MAPK14 Q16539 2/20 0.39
TNNI3K Q59H18 2/20 0.39

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
SCHEMBL5449160 1.00 MAP2K7 (0.45) MAP2K7GAAMAPTHTTHDAC3
SCHEMBL5317895 0.87 MAP2K7 (0.49) MAP2K7GAAMAPTHTTKDR
SCHEMBL5317897 0.87 MAP2K7 (0.49) MAP2K7GAAMAPTHTTKDR
SCHEMBL5319484 0.84 MAP2K7 (0.44) MAP2K7KDRBRAFMAPK14TNNI3K
SCHEMBL5319477 0.84 MAP2K7 (0.44) MAP2K7KDRBRAFMAPK14TNNI3K
SCHEMBL5444516 0.84 MAP2K7 (0.48) MAP2K7KDRBRAFMAPK14TNNI3K
SCHEMBL5319331 0.83 MAP2K7 (0.47) MAP2K7MAPTKDRBRAFMAPK14
SCHEMBL5318656 0.83 MAP2K7 (0.47) MAP2K7KDRBRAFMAPK14TNNI3K
SCHEMBL14447612 0.81 MAP2K7 (0.48) MAP2K7KDRBRAFMAPK14TNNI3K
SCHEMBL14447614 0.81 MAP2K7 (0.46) MAP2K7KDRBRAFMAPK14TNNI3K

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 MAP2K7 141/4885GAA 3362/4885MAPT 2911/4885

“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.