SCHEMBL5107210

SCHEMBL5107210

CNc1ncnc2c1ncn2-c1ccc(NC(=O)Nc2ccc(OC3CCN(C)CC3)c(C(F)(F)F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 8/20 0.51
▸ BRAF P15056 7/20 0.51
▸ FGFR1 P11362 1/20 0.50
▸ RAF1 P04049 3/20 0.48
▸ ARAF P10398 3/20 0.48
▸ ABL1 P00519 3/20 0.42
▸ MAPK14 Q16539 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ F10 P00742 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.40
▸ PIK3CD O00329 1/20 0.38
▸ CHEK1 O14757 1/20 0.38

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
SCHEMBL5139333 0.92 KDR (0.49) KDRBRAFFGFR1RAF1ARAF
SCHEMBL5105268 0.90 KDR (0.52) KDRBRAFFGFR1RAF1ARAF
SCHEMBL5106674 0.86 KDR (0.51) KDRBRAFFGFR1ABL1GPR119
SCHEMBL5118843 0.86 HTR2A (0.45) KDRBRAFFGFR1RAF1ABL1
SCHEMBL5113096 0.83 FLT4 (0.51) KDRBRAFFGFR1ABL1
SCHEMBL5104150 0.82 KDR (0.42) KDRBRAFRAF1ARAFABL1
SCHEMBL5111764 0.82 RAF1 (0.43) KDRBRAFRAF1ABL1
SCHEMBL5119586 0.81 SRC (0.56) KDRBRAFFGFR1RAF1ABL1
SCHEMBL5107344 0.81 BRAF (0.52) KDRBRAFRAF1ARAFMAPK14
SCHEMBL5118545 0.81 CTSS (0.43) KDRBRAFABL1

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 5 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
US-20080119466-A1 Heteroarylphenylurea Derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-05-22 — — 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 KDR 2440/4885BRAF 1735/4885FGFR1 982/4885

“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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