SCHEMBL1382827

SCHEMBL1382827

Oc1cc(CCc2cnc(Nc3cccc(C(F)(F)F)c3)c3ccccc23)ccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 5/20 0.48
▸ ABCG2 Q9UNQ0 4/20 0.48
▸ TSHR P16473 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ KDR P35968 4/20 0.47
▸ NR3C2 P08235 1/20 0.43
▸ FLT1 P17948 2/20 0.42
▸ PTK6 Q13882 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ GMNN O75496 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TTR P02766 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ UGT1A1 P22309 1/20 0.42
▸ PTGS1 P23219 1/20 0.42

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
SCHEMBL1385761 0.87 KDR (0.39) EGFRABCG2TSHRHTTKDR
SCHEMBL1383615 0.85 KDR (0.48) EGFRABCG2TSHRHTTKDR
SCHEMBL1383042 0.84 KIF11 (0.53) EGFRABCG2TSHRHTTKDR
SCHEMBL1383441 0.81 EGFR (0.49) EGFRABCG2TSHRHTTKDR
SCHEMBL1386144 0.77 NR3C2 (0.34) EGFRABCG2KDRNR3C2FLT1
SCHEMBL1384331 0.77 NAMPT (0.36) KDRNR3C2FLT1MEN1LMNA
SCHEMBL1386811 0.75 KDR (0.44) EGFRABCG2TSHRHTTKDR
SCHEMBL1383596 0.74 KDR (0.38) EGFRABCG2KDRFLT1SYK
SCHEMBL1385961 0.73 MEN1 (0.44) EGFRABCG2HTTKDRMEN1
SCHEMBL4824553 0.73 KDM4E (0.48) EGFRABCG2TSHRHTTKDR

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 EGFR 15/4885ABCG2 835/4885TSHR 1449/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR EGFR 12/4885ABCG2 585/4885TSHR 1241/4885

“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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