SCHEMBL4824964

SCHEMBL4824964

COc1ccc(Cc2c(C)nc(Cl)c3ccccc23)cn1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.41
NPSR1 Q6W5P4 1/20 0.40
RORC P51449 1/20 0.38
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.35
KDM4E B2RXH2 1/20 0.35
KDR P35968 1/20 0.35
NAMPT P43490 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL4832538 0.84 GAA (0.41) PDE10ANPSR1SMN1; SMN2ALDH1A1LMNA
SCHEMBL4824943 0.77 KCNH2 (0.43) PDE10AKDM1AMAOAMAOBCYP2C9
SCHEMBL1931675 0.76 KDR (0.44) NPSR1KDM1AMAOAMAOBALDH1A1
SCHEMBL30106677 0.75 NPC1 (0.41) PDE10AKDM1AMAOAMAOBSMN1; SMN2
SCHEMBL4832266 0.73 PDE10A (0.46) PDE10AKCNH2
SCHEMBL1601388 0.71 LTA4H (0.55) KDM1AMAOAMAOBLMNAKDR
SCHEMBL29442837 0.70 NPC1 (0.46) KDM1AMAOAMAOBSMN1; SMN2ALDH1A1
SCHEMBL21384141 0.70 NPC1 (0.46) KDM1AMAOAMAOBSMN1; SMN2ALDH1A1
SCHEMBL1470360 0.69 L3MBTL1 (0.44) NPSR1MAOAMAOBSMN1; SMN2ALDH1A1
SCHEMBL4832584 0.68 CYP2C9 (0.40) NPSR1KDM1AMAOAMAOBCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7323474-B2 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase NOVARTIS AG (CH) 2008-01-29 US disclosed
EP-1254138-B1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2005-05-11 EP disclosed
US-20040209894-A1 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase BOLD GUIDO 2004-10-21 US disclosed
US-6706731-B2 WITH ISOQUINOLINE DERIVATIVES AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2004-03-16 US disclosed
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase NOVARTIS AG (CH) 2003-08-21 US disclosed
EP-1254138-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE Novartis AG (CH) 2002-11-06 EP disclosed
WO-2001058899-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2001-08-16 WO disclosed

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 PDE10A 772/4885NPSR1 732/4885RORC 1241/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR PDE10A 687/4885NPSR1 731/4885RORC 952/4885

“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.