SCHEMBL5108237

SCHEMBL5108237

CN(C(=O)OC(C)(C)C)c1ncnc2c1ncn2-c1ccc(NC(=O)Nc2ccc(C(O)O)c(C(F)(F)F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.40
▸ PTK2B Q14289 1/20 0.40
▸ KDR P35968 8/20 0.38
▸ BRAF P15056 7/20 0.37
▸ RAF1 P04049 3/20 0.37
▸ AURKA O14965 1/20 0.36
▸ AURKB Q96GD4 1/20 0.36
▸ FGFR3 P22607 1/20 0.35
▸ MAPK14 Q16539 3/20 0.34
▸ TNNI3K Q59H18 3/20 0.34
▸ S1PR1 P21453 1/20 0.33
▸ DDX3X O00571 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL5118992 0.93 PTK2 (0.39) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5106909 0.89 RAF1 (0.44) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5119150 0.89 PTK2 (0.40) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5105278 0.88 PTK2B (0.41) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5105956 0.88 PTK2 (0.40) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5109860 0.86 PTK2B (0.39) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5110943 0.86 PTK2B (0.39) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5112032 0.85 KDR (0.45) PTK2PTK2BKDRBRAFRAF1
SCHEMBL5110253 0.82 PTK2 (0.42) PTK2PTK2BKDRBRAFAURKA
SCHEMBL5110968 0.82 KDR (0.49) PTK2PTK2BKDRBRAFRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8609656-B2 Heteroarylphenylurea derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2013-12-17 — — US disclosed
US-20080119466-A1 Heteroarylphenylurea Derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-05-22 — — US disclosed
EP-1724258-A1 HETEROARYLPHENYLUREA DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-11-22 — — EP 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-20080119466-A1 Heteroarylphenylurea Derivative CHRM1, CBR3, CHRM2 PTK2 3377/4885PTK2B 2304/4885KDR 2440/4885

“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.

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