SCHEMBL4507986

SCHEMBL4507986

COc1ccc2ncc(N)c(Cl)c2n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 6/20 0.41
PTPN11 Q06124 8/20 0.39
PIK3CD O00329 1/20 0.37
PIP5K1C O60331 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PI4KA P42356 1/20 0.37
PIK3CG P48736 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
EGFR P00533 1/20 0.36
PDE10A Q9Y233 1/20 0.35
KCNH2 Q12809 1/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
G6PD P11413 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
SCHEMBL28867703 0.83 PTPN11 (0.38) MAP4K4PTPN11EGFRPDE10AKCNH2
SCHEMBL15981926 0.82 MAP4K4 (0.42) MAP4K4PIK3CDPIP5K1CPIK3CAPIK3CB
SCHEMBL2949290 0.81 MAP4K4 (0.41) MAP4K4PIK3CDPIP5K1CPIK3CAPIK3CB
SCHEMBL2038848 0.81 MAP4K4 (0.41) MAP4K4PIK3CDPIP5K1CPIK3CAPIK3CB
SCHEMBL5437179 0.81 MAP4K4 (0.41) MAP4K4PTPN11PIK3CDPIP5K1CPIK3CA
SCHEMBL4502318 0.81 KCNH2 (0.43) PTPN11EGFRKCNH2
SCHEMBL14905348 0.81 EGFR (0.41) MAP4K4PTPN11EGFRPDE10AKCNH2
SCHEMBL31391938 0.79 MAP4K4 (0.38) MAP4K4PTPN11PIK3CDPIP5K1CPIK3CA
SCHEMBL29050347 0.79 MAP4K4 (0.38) MAP4K4PTPN11PIK3CDPIP5K1CPIK3CA
SCHEMBL29698555 0.79 MAP4K4 (0.38) MAP4K4PTPN11PIK3CDPIP5K1CPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131444-A1 Aminopiperidine Quinolines and Their Azaisosteric Analogues with Antibacterial Activity ASTRAZENECA AB (SE) 2009-05-21 US disclosed
EP-1891078-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006125974-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2006-11-30 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-20090131444-A1 Aminopiperidine Quinolines and Their Azaisosteric Analogues with Antibacterial Activity AAAS, AMPD2, AMPD3 MAP4K4 2030/4885PTPN11 3293/4885PIK3CD 301/4885

“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.