SCHEMBL5055075

SCHEMBL5055075

CNc1ncc2cc(-c3cccc(NC(=O)Nc4cn(C(C)(C)C)nc4-c4cccc(C#N)c4)c3)c(=O)n(C)c2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.42
CASP1 P29466 4/20 0.42
CASP7 P55210 4/20 0.42
USP2 O75604 4/20 0.42
CYP3A4 P08684 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 2/20 0.42
CYP2D6 P10635 2/20 0.42
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
FGFR1 P11362 6/20 0.41
SRC P12931 2/20 0.41
EGFR P00533 1/20 0.41
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
ABL1 P00519 3/20 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
SCHEMBL5054950 0.94 FGFR1 (0.41) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5055027 0.91 BRAF (0.46) CYP1A2CASP1CASP7USP2CYP3A4
SCHEMBL5052198 0.91 FGFR1 (0.38) CYP1A2CASP1CASP7USP2CYP3A4
SCHEMBL5052180 0.91 SRC (0.45) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5060059 0.90 FGFR1 (0.40) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5056404 0.89 RAF1 (0.46) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5054586 0.88 FGFR1 (0.44) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5055093 0.88 RAF1 (0.46) CYP1A2CASP1CASP7USP2MEN1
SCHEMBL5062006 0.87 SRC (0.42) FGFR1SRCEGFRRAF1BRAF
SCHEMBL5054896 0.87 FGFR1 (0.42) FGFR1SRCEGFRRAF1BRAF

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 CYP1A2 2430/4885CASP1 1352/4885CASP7 2457/4885

“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.