SCHEMBL13756767

SCHEMBL13756767

CC(=O)c1ccc(N2CCc3cnc(Nc4ccc(F)cc4)nc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 3/20 0.46
▸ AURKA O14965 1/20 0.46
▸ CCNA2 P20248 1/20 0.46
▸ PLK1 P53350 1/20 0.46
▸ CCNA1 P78396 1/20 0.46
▸ JAK2 O60674 2/20 0.46
▸ FLT3 P36888 2/20 0.46
▸ FGFR1 P11362 2/20 0.45
▸ EGFR P00533 1/20 0.45
▸ FYN P06241 1/20 0.45
▸ PDGFRB P09619 1/20 0.45
▸ PDGFRA P16234 1/20 0.45
▸ PRKACA P17612 1/20 0.45
▸ FGFR2 P21802 1/20 0.45
▸ FGFR4 P22455 1/20 0.45
▸ FGFR3 P22607 1/20 0.45
▸ PRKACG P22612 1/20 0.45
▸ PRKACB P22694 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ KDR P35968 1/20 0.45

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
SCHEMBL13756837 0.87 CDK2 (0.56) CDK2CCNA2JAK2PDGFRBPDGFRA
SCHEMBL13756838 0.87 GRM5 (0.53) CDK2CCNA2JAK2EGFRCCNT1
SCHEMBL13756846 0.87 CDK2 (0.44) CDK2AURKACCNA2PLK1CCNA1
SCHEMBL13756839 0.84 JAK2 (0.55) CDK2CCNA2JAK2FLT3CDK4
SCHEMBL13756756 0.83 PTGS2 (0.48) CDK2AURKAJAK2FGFR1EGFR
SCHEMBL13756757 0.80 EPHX2 (0.56) AURKAFLT3PDGFRBPDGFRAALDH1A1
SCHEMBL13756798 0.79 HSD17B10 (0.54) JAK2ALDH1A1BRD4JAK3
SCHEMBL13756799 0.78 CDK2 (0.53) CDK2CCNA2FLT3EGFRCDK4
SCHEMBL13756696 0.76 CSF1R (0.46) CDK2CCNA2JAK2FLT3CDK4
SCHEMBL13756776 0.74 PDGFRB (0.52) CDK2CCNA2JAK2PDGFRBPDGFRA

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-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 — — US 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 CDK2 77/4885AURKA 755/4885CCNA2 958/4885

“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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