SCHEMBL1383073

SCHEMBL1383073

COc1cc(CCc2cnc(Nc3ccc(C(C)C)c(C)c3)c3ccccc23)ccn1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ MAPT P10636 4/20 0.34
▸ EGFR P00533 1/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ LOX P28300 1/20 0.34
▸ LOXL2 Q9Y4K0 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ PLA2G7 Q13093 1/20 0.34
▸ NR3C2 P08235 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NAMPT P43490 1/20 0.33
▸ FLT1 P17948 3/20 0.33
▸ KDR P35968 3/20 0.33
▸ PDGFRB P09619 2/20 0.33
▸ KIT P10721 2/20 0.33
▸ TP53 P04637 1/20 0.33

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
SCHEMBL1384331 0.87 NAMPT (0.36) MAPTCYP1A2NR3C2GAASMN1; SMN2
SCHEMBL1383433 0.83 NAMPT (0.47) MAPTEGFRERBB2CYP1A2NAMPT
SCHEMBL1383890 0.82 GAA (0.37) MAPTPLA2G7GAANAMPTKDR
SCHEMBL1385899 0.80 EGFR (0.36) MAPTEGFRLOXLOXL2CYP1A2
SCHEMBL7205123 0.79 FLT1 (0.44) EGFRSMN1; SMN2NAMPTFLT1KDR
SCHEMBL1383615 0.79 KDR (0.48) CDK2MAPTEGFRFLT1KDR
SCHEMBL13955413 0.76 KDR (0.37) MAPTCYP1A2GAASMN1; SMN2FLT1
SCHEMBL1383596 0.75 KDR (0.38) MAPTEGFRFLT1KDRABCG2
SCHEMBL1387010 0.73 IRAK4 (0.38) LOXLOXL2CYP1A2PLA2G7NR3C2
SCHEMBL4832226 0.73 IRAK4 (0.38) LOXLOXL2CYP1A2PLA2G7NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4837864-B2 — — 2011-12-14 — — JP claimed
US-7323474-B2 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase NOVARTIS AG (CH) 2008-01-29 — — US claimed
EP-1254138-B1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2005-05-11 — — EP claimed
US-20040209894-A1 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase BOLD GUIDO 2004-10-21 — — US claimed
US-6706731-B2 WITH ISOQUINOLINE DERIVATIVES AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2004-03-16 — — US claimed
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase NOVARTIS AG (CH) 2003-08-21 — — US claimed
EP-1254138-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE Novartis AG (CH) 2002-11-06 — — EP claimed
WO-2001058899-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2001-08-16 — — WO 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 (2 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-20040209894-A1 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase FLT1, FLT4, KDR CCNK 322/4885CCNA2 847/4885CDK2 115/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR CCNK 271/4885CCNA2 919/4885CDK2 127/4885

“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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