SCHEMBL5350951

SCHEMBL5350951

CN1CCN(Cc2cc(NC(=O)Nc3cccc(Oc4cc(-c5ncco5)ncn4)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.54
BRAF P15056 5/20 0.54
RAF1 P04049 2/20 0.54
FGFR1 P11362 1/20 0.51
MAPK14 Q16539 3/20 0.50
TNNI3K Q59H18 3/20 0.50
DDR1 Q08345 9/20 0.49
DDR2 Q16832 9/20 0.49
KIT P10721 4/20 0.49
ABL1 P00519 7/20 0.46
NTRK1 P04629 1/20 0.46
NTRK3 Q16288 1/20 0.46
NTRK2 Q16620 1/20 0.46
BCR P11274 2/20 0.45

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
SCHEMBL5336881 0.90 RAF1 (0.53) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL5342028 0.82 KDR (0.58) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL5337876 0.82 RAF1 (0.61) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL4929645 0.78 KDR (0.65) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL4769351 0.77 KDR (0.64) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL4769465 0.76 KDR (0.65) KDRBRAFRAF1FGFR1MAPK14
SCHEMBL5338918 0.75 KDR (0.68) KDRBRAFFGFR1MAPK14DDR1
SCHEMBL5341962 0.75 KDR (0.63) KDRBRAFRAF1
SCHEMBL5342064 0.74 KDR (0.46) KDRBRAFRAF1MAPK14TNNI3K
SCHEMBL3173197 0.71 KDR (0.59) KDRBRAFRAF1FGFR1MAPK14

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
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
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 555/4885BRAF 1/4885RAF1 3/4885

“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.