SCHEMBL5052246

SCHEMBL5052246

CNc1ncc2cc(-c3cccc(NC(=O)Nc4cn(C(C)(C)C)nc4-c4ccc(C#N)nc4)c3)c(=O)n(C(C)C)c2n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 10/20 0.37
KDR P35968 2/20 0.35
LCK P06239 1/20 0.35
JAK3 P52333 1/20 0.35
MAPK14 Q16539 1/20 0.35
RAF1 P04049 2/20 0.32
BRAF P15056 2/20 0.32
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
EGFR P00533 2/20 0.31
SRC P12931 1/20 0.31
TTK P33981 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CCND2 P30279 1/20 0.31
CCND3 P30281 1/20 0.31
KRAS P01116 1/20 0.30

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
SCHEMBL5054887 0.92 FGFR1 (0.38) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5060059 0.91 FGFR1 (0.40) FGFR1MAPK14RAF1BRAFEGFR
SCHEMBL5052198 0.91 FGFR1 (0.38) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5052186 0.90 BRAF (0.40) FGFR1KDRMAPK14RAF1BRAF
SCHEMBL5054864 0.90 CDK4 (0.38) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5062750 0.89 IGF1R (0.37) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5054969 0.89 KDR (0.38) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5062384 0.87 FGFR1 (0.35) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5060234 0.86 KDR (0.34) FGFR1KDRLCKJAK3MAPK14
SCHEMBL5052101 0.86 NTRK1 (0.38) FGFR1KDRLCKJAK3MAPK14

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 FGFR1 184/4885KDR 41/4885LCK 28/4885

“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.