SCHEMBL3668181

SCHEMBL3668181

CN(C)C(C)(C)c1ccc(-c2cncc(B3OC(C)(C)C(C)(C)O3)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.40
LPL P06858 8/20 0.40
KIF11 P52732 1/20 0.33
FFAR1 O14842 1/20 0.33
PDGFRB P09619 1/20 0.32
KDR P35968 1/20 0.32
F11 P03951 1/20 0.32
DGAT1 O75907 2/20 0.31
SNCA P37840 1/20 0.31
AAK1 Q2M2I8 1/20 0.30

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
SCHEMBL3663492 0.85 LIPG (0.35) LIPGLPLFFAR1PDGFRBKDR
SCHEMBL3667114 0.79 LPL (0.49) LIPGLPLFFAR1F11
SCHEMBL1908908 0.78 LIPG (0.66) LIPGLPLPDGFRBKDR
SCHEMBL3801908 0.78 HRH3 (0.45) LIPGLPLF11DGAT1
SCHEMBL3796275 0.78 LIPG (0.62) LIPGLPLPDGFRBKDRDGAT1
SCHEMBL3802309 0.76 LPL (0.36) LIPGLPLFFAR1
SCHEMBL3666319 0.76 LIPG (0.35) LIPGLPLFFAR1PDGFRBKDR
SCHEMBL22553957 0.76 CYP11B2 (0.41) LIPGLPLPDGFRBKDR
SCHEMBL3663224 0.76 SNCA (0.48) LIPGLPLDGAT1SNCA
SCHEMBL28563382 0.75 LIPG (0.42) LIPGLPLFFAR1PDGFRBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314112-B2 Pyrrolopyrimidines and pyrrolopyridines NOVARTIS AG (CH) 2012-11-20 US disclosed
EP-2242756-A2 PYRROLOPYRIMIDINES AND PYRROLOPYRIDINES Novartis AG (CH) 2010-10-27 EP disclosed
US-20090181941-A1 Pyrrolopyrimidines and Pyrrolopyridines NOVARTIS AG (CH) 2009-07-16 US disclosed
WO-2009087225-A2 PYRROLOPYRIMIDINES AND PYRROLOPYRIDINES NOVARTIS AG (CH) 2009-07-16 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 (1 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-20090181941-A1 Pyrrolopyrimidines and Pyrrolopyridines ALK, ACVR1, PTPN4 LIPG 2295/4885LPL 2217/4885KIF11 4342/4885

“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.