SCHEMBL1383679

SCHEMBL1383679

Cc1ccc(CCc2cnc(Nc3cc(Cl)cc(C(F)(F)F)c3)c3ccccc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 1/20 0.38
▸ KDR P35968 5/20 0.36
▸ FLT1 P17948 3/20 0.36
▸ HDAC1 Q13547 2/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ EGFR P00533 2/20 0.35
▸ ABCG2 Q9UNQ0 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CTSC P53634 2/20 0.34
▸ VNN1 O95497 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ EPAS1 Q99814 1/20 0.34
▸ P2RX3 P56373 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAF1 P04049 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
SCHEMBL1385235 0.87 NAMPT (0.46) KDRFLT1HDAC1HDAC6HDAC3
SCHEMBL1383441 0.87 EGFR (0.49) KDREGFRABCG2TSHRHTT
SCHEMBL1385761 0.82 KDR (0.39) RAPGEF4KDRFLT1HDAC1HDAC6
SCHEMBL1383596 0.81 KDR (0.38) RAPGEF4KDRFLT1HDAC1HDAC6
SCHEMBL1386811 0.80 KDR (0.44) KDRFLT1EGFRABCG2TSHR
SCHEMBL1383635 0.79 KDR (0.38) KDRFLT1ABCG2NAMPTGAA
SCHEMBL7105495 0.77 NPC1 (0.36) HDAC1HDAC3HDAC2NAMPTGAA
SCHEMBL1383229 0.77 GAA (0.40) KDRFLT1NAMPTGAA
SCHEMBL1383724 0.76 KDR (0.53) KDRFLT1EGFRABCG2CTSC
SCHEMBL1383042 0.74 KIF11 (0.53) KDRFLT1EGFRABCG2TSHR

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 RAPGEF4 1351/4885KDR 3/4885FLT1 1/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR RAPGEF4 1213/4885KDR 3/4885FLT1 1/4885

“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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