SCHEMBL5052151

SCHEMBL5052151

CNc1ncc2cc(-c3cc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccc5c(c4)CCNC5)ccc3C)c(=O)n(C)c2n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.46
DDR2 Q16832 1/20 0.45
WEE1 P30291 10/20 0.43
BRAF P15056 3/20 0.42
RAF1 P04049 1/20 0.42
SYK P43405 1/20 0.42
MAPK14 Q16539 3/20 0.41
MAPK13 O15264 2/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
PTK2 Q05397 1/20 0.41

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
SCHEMBL5052262 0.85 ABL1 (0.52) ABL1DDR2WEE1BRAFRAF1
SCHEMBL5056340 0.84 MAPK14 (0.46) DDR2BRAFRAF1SYKMAPK14
SCHEMBL5060642 0.83 DDR2 (0.47) DDR2BRAFRAF1SYKMAPK14
SCHEMBL5056346 0.83 ABL1 (0.53) ABL1DDR2BRAFRAF1SYK
SCHEMBL5052196 0.83 ABL1 (0.56) ABL1DDR2BRAFRAF1SYK
SCHEMBL5052319 0.83 DDR2 (0.46) DDR2BRAFRAF1SYKMAPK14
SCHEMBL5062066 0.83 RAF1 (0.46) WEE1BRAFRAF1SYKMAPK14
SCHEMBL4420794 0.83 SYK (0.52) DDR2BRAFRAF1SYKMAPK14
SCHEMBL5062298 0.83 DDR2 (0.47) DDR2BRAFRAF1SYKMAPK14
SCHEMBL5056424 0.82 ABL1 (0.45) ABL1WEE1MAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US claimed

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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 ABL1 20/4885DDR2 1256/4885WEE1 890/4885

“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.