SCHEMBL1386333

SCHEMBL1386333

CCc1ccc(Nc2ncc(CCc3ccc(C)nc3)c3ccccc23)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.36
▸ NAMPT P43490 1/20 0.35
▸ KDR P35968 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ GRM5 P41594 7/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ EGFR P00533 2/20 0.33
▸ MET P08581 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1386555 0.88 MEN1 (0.39) MAPTNAMPTKDREGFRCYP1A2
SCHEMBL1383229 0.84 GAA (0.40) MAPTNAMPTKDRGAAGRM5
SCHEMBL4824885 0.82 KDR (0.36) MAPTKDRGAAEGFRCYP1A2
SCHEMBL1386144 0.82 NR3C2 (0.34) MAPTKDRGAAHDAC3HDAC1
SCHEMBL1383635 0.81 KDR (0.38) MAPTNAMPTKDRGAAGRM5
SCHEMBL1385899 0.81 EGFR (0.36) MAPTKDRGAAEGFRCYP1A2
SCHEMBL1386447 0.80 AURKA (0.37) MAPTKDRGAAEGFRMET
SCHEMBL1383890 0.80 GAA (0.37) MAPTNAMPTKDRGAAGRM5
SCHEMBL1383925 0.78 MEN1 (0.40) KDREGFRCYP1A2
SCHEMBL13955593 0.78 FLT1 (0.43) MAPTKDREGFRSMN1; SMN2

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 MAPT 2394/4885NAMPT 599/4885KDR 3/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR MAPT 1907/4885NAMPT 442/4885KDR 3/4885

“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.

Send feedback