SCHEMBL7971457

SCHEMBL7971457

CCc1ccc(-c2nc3ncnc(N)c3cc2-c2ccc(C)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADK P55263 17/20 0.71
AKT1 P31749 2/20 0.49
AKT2 P31751 2/20 0.49

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 0.91 ADK (0.83) ADK
SCHEMBL7974874 0.87 ADK (0.77) ADKAKT1AKT2
SCHEMBL7974716 0.86 ADK (0.76) ADKAKT1AKT2
SCHEMBL810187 0.85 ADK (0.76) ADK
SCHEMBL7973058 0.85 ADK (0.74) ADKAKT1AKT2
SCHEMBL7961356 0.85 ADK (0.78) ADKAKT1AKT2
SCHEMBL7971554 0.85 ADK (0.74) ADK
SCHEMBL7973122 0.85 ADK (0.77) ADK
SCHEMBL7973088 0.84 ADK (0.65) ADKAKT1AKT2
SCHEMBL7972976 0.83 ADK (1.00) ADKAKT1AKT2

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 disclosed
WO-1998046603-A1 6,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 1998-10-22 WO disclosed