SCHEMBL8143407

SCHEMBL8143407

Cc1ccc(-c2cc3c(N)ncnc3nc2-c2cccnc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADK P55263 15/20 0.75
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
PPARG P37231 1/20 0.48
MCL1 Q07820 1/20 0.48
NR2E3 Q9Y5X4 1/20 0.48
NCOR2 Q9Y618 1/20 0.48
AKT1 P31749 2/20 0.45
AKT2 P31751 2/20 0.45
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44

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
SCHEMBL7974716 0.87 ADK (0.76) ADKKDM4EPOLBPPARGMCL1
SCHEMBL8153484 0.86 ADK (0.83) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7972976 0.86 ADK (1.00) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7961356 0.85 ADK (0.78) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7974874 0.83 ADK (0.77) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7961360 0.82 ADK (0.66) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7974699 0.81 ADK (0.65) ADKKDM4EPOLBPPARGMCL1
SCHEMBL810187 0.81 ADK (0.76) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7973058 0.81 ADK (0.74) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7971554 0.81 ADK (0.74) ADKKDM4EPOLBPPARGMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0979230-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS Abbott Laboratories (US) 2000-02-16 EP disclosed
WO-1998046603-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 1998-10-22 WO disclosed