SCHEMBL8153484

SCHEMBL8153484

Cc1ccc(-c2cc3c(N)ncnc3nc2-c2ccc(C)cc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADK P55263 17/20 0.83
KDM4E B2RXH2 2/20 0.51
PPARG P37231 2/20 0.51
MCL1 Q07820 2/20 0.51
NR2E3 Q9Y5X4 2/20 0.51
NCOR2 Q9Y618 2/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 1/20 0.50
PTK2B Q14289 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL7974874 0.96 ADK (0.77) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7974716 0.95 ADK (0.76) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7973058 0.93 ADK (0.74) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7961356 0.93 ADK (0.78) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL810187 0.93 ADK (0.76) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7971554 0.93 ADK (0.74) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7972976 0.91 ADK (1.00) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL8137566 0.91 ADK (0.71) ADKKDM4EPPARGMCL1NR2E3
SCHEMBL7971457 0.91 ADK (0.71) ADK
SCHEMBL7971303 0.91 ADK (1.00) ADK

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