SCHEMBL5062298

SCHEMBL5062298

CNc1ncc2cc(-c3cc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccc5ocnc5c4)ccc3C)c(=O)n(C)c2n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DDR2 Q16832 1/20 0.47
SYK P43405 1/20 0.43
MAPK14 Q16539 6/20 0.43
MAPK13 O15264 4/20 0.43
MAPK12 P53778 4/20 0.43
MAPK11 Q15759 4/20 0.43
PTK2 Q05397 8/20 0.42
BRAF P15056 4/20 0.42
RAF1 P04049 1/20 0.42
PTK2B Q14289 1/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL5052319 0.89 DDR2 (0.46) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5060642 0.87 DDR2 (0.47) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5052196 0.86 ABL1 (0.56) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5056346 0.86 ABL1 (0.53) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5052306 0.85 BRAF (0.45) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5056340 0.85 MAPK14 (0.46) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL4420794 0.84 SYK (0.52) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5052151 0.83 ABL1 (0.46) DDR2SYKMAPK14MAPK13MAPK12
SCHEMBL5060207 0.82 RAF1 (0.46) DDR2SYKMAPK14BRAFRAF1
SCHEMBL5056443 0.81 NTRK1 (0.37) DDR2MAPK14MAPK13MAPK12MAPK11

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 DDR2 1256/4885SYK 92/4885MAPK14 100/4885

“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.