SCHEMBL5419476

SCHEMBL5419476

O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cccc(Oc2cc(-c3nnco3)ncn2)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.54
MAPK14 Q16539 15/20 0.54
TNNI3K Q59H18 15/20 0.54
BRAF P15056 15/20 0.54
FLT3 P36888 1/20 0.52
MAP2K7 O14733 1/20 0.48

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
SCHEMBL5424039 0.88 KDR (0.62) KDRBRAF
SCHEMBL5341654 0.88 KDR (0.54) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL5340417 0.84 MAP2K7 (0.46) KDRTNNI3KMAP2K7
SCHEMBL5342064 0.84 KDR (0.46) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL5337876 0.82 RAF1 (0.61) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL5333931 0.81 KDR (0.61) KDRBRAFFLT3
SCHEMBL5336881 0.81 RAF1 (0.53) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL14447654 0.81 KDR (0.45) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL14447617 0.81 MAP2K7 (0.43) KDRMAPK14TNNI3KBRAFMAP2K7
SCHEMBL5453242 0.80 MCHR1 (0.46) KDRMAPK14TNNI3KBRAF

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-20070155764-A1 NOVEL SUBSTITUTED PYRIMIDINYLOXY UREAS USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed
WO-2007076473-A2 SUBSTITUTED PYRIMIDINYLOXY UREAS USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 WO disclosed
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 KDR 555/4885MAPK14 193/4885TNNI3K 112/4885

“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.