SCHEMBL1384788

SCHEMBL1384788

COc1ccc(Cc2cnc(NC3CCC(C(C)C)C(C)C3)c3ccccc23)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.39
▸ KDM1A O60341 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ CHRNA7 P36544 2/20 0.36
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ CACNA1G O43497 1/20 0.32
▸ CACNA1H O95180 1/20 0.32
▸ CACNA1I Q9P0X4 1/20 0.32
▸ PDE5A O76074 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TRPV6 Q9H1D0 1/20 0.32
▸ KAT2B Q92831 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ NAMPT P43490 1/20 0.32
▸ ACACB O00763 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HRH1 P35367 1/20 0.31
▸ PIK3CD O00329 1/20 0.31

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
SCHEMBL1385914 0.87 CHRM1 (0.30) —
SCHEMBL1383320 0.87 KCNH2 (0.41) KCNH2KDM1AMAOAMAOBCHRNA7
SCHEMBL6221506 0.87 KCNH2 (0.41) KCNH2KDM1AMAOAMAOBCHRNA7
SCHEMBL4828194 0.76 GRM4 (0.45) KCNH2KDM1AMAOAMAOBCHRNA7
SCHEMBL1382638 0.73 GRM4 (0.38) KCNH2CYP3A4CYP2C9CYP2C19
SCHEMBL6226746 0.73 GRM4 (0.38) KCNH2CYP3A4CYP2C9CYP2C19
SCHEMBL1929839 0.72 KDR (0.42) KCNH2KDM1AMAOAMAOB
SCHEMBL4824943 0.68 KCNH2 (0.43) KCNH2KDM1AMAOAMAOBPDE10A
SCHEMBL1385506 0.68 KDR (0.44) KCNH2KDM1ANAMPTPIK3CD
SCHEMBL1931638 0.67 KDR (0.41) KDM1AMAOAMAOBCHRNA7

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 KCNH2 2601/4885KDM1A 967/4885MAOA 390/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR KCNH2 2850/4885KDM1A 1212/4885MAOA 351/4885

“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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