SCHEMBL7971554

SCHEMBL7971554

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

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADK P55263 14/20 0.74
CNR1 P21554 4/20 0.51
CNR2 P34972 2/20 0.51
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
PPARG P37231 1/20 0.46
MCL1 Q07820 1/20 0.46
NR2E3 Q9Y5X4 1/20 0.46
NCOR2 Q9Y618 1/20 0.46

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
SCHEMBL8153484 0.93 ADK (0.83) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7961536 0.91 ADK (0.69) ADKCNR1CNR2KDM4EPOLB
SCHEMBL7974874 0.90 ADK (0.77) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7974716 0.88 ADK (0.76) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7974699 0.88 ADK (0.65) ADKCNR1CNR2KDM4EPOLB
SCHEMBL810187 0.87 ADK (0.76) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7961356 0.87 ADK (0.78) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7973058 0.87 ADK (0.74) ADKKDM4EPOLBPPARGMCL1
SCHEMBL8137566 0.85 ADK (0.71) ADKKDM4EPOLBPPARGMCL1
SCHEMBL7971457 0.85 ADK (0.71) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001057040-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2001-08-09 WO claimed
EP-0979230-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS Abbott Laboratories (US) 2000-02-16 EP claimed
WO-1998046603-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 1998-10-22 WO claimed