SCHEMBL5108134

SCHEMBL5108134

CNc1ncnc2c1ncn2-c1ccc(NC(=O)Nc2ccc(CCCN3CCCC3)c(C(F)(F)F)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 5/20 0.43
▸ SRC P12931 6/20 0.43
▸ KDR P35968 5/20 0.43
▸ EGFR P00533 4/20 0.43
▸ CDK8 P49336 4/20 0.43
▸ RET P07949 3/20 0.43
▸ BRAF P15056 2/20 0.43
▸ PTK2B Q14289 2/20 0.43
▸ FGFR4 P22455 2/20 0.43
▸ CDK2 P24941 2/20 0.43
▸ FLT1 P17948 2/20 0.43
▸ FLT4 P35916 2/20 0.43
▸ STK25 O00506 1/20 0.43
▸ CIT O14578 1/20 0.43
▸ MAP2K7 O14733 1/20 0.43
▸ IKBKB O14920 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ GAK O14976 1/20 0.43
▸ CHUK O15111 1/20 0.43
▸ MUSK O15146 1/20 0.43

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
SCHEMBL5112597 0.99 ABL1 (0.43) ABL1SRCKDREGFRCDK8
SCHEMBL5106242 0.95 ABL1 (0.46) ABL1SRCKDREGFRCDK8
SCHEMBL5109035 0.95 SRC (0.46) ABL1SRCKDREGFRCDK8
SCHEMBL5110191 0.95 ABL1 (0.46) ABL1SRCKDREGFRCDK8
SCHEMBL5114066 0.93 BRAF (0.47) ABL1SRCKDREGFRCDK8
SCHEMBL5105942 0.91 SRC (0.52) ABL1SRCKDREGFRCDK8
SCHEMBL5139616 0.90 SRC (0.44) ABL1SRCKDREGFRCDK8
SCHEMBL5108290 0.90 SRC (0.47) ABL1SRCKDREGFRCDK8
SCHEMBL5109138 0.90 SRC (0.51) ABL1SRCKDREGFRCDK8
SCHEMBL5110761 0.89 MKNK2 (0.51) ABL1SRCKDREGFRCDK8

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-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
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 ABL1 128/4885SRC 749/4885KDR 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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