SCHEMBL7433198

SCHEMBL7433198

CCc1cc(Cl)n2nc(CC)c(C)c2n1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.36
CCNE2 O96020 2/20 0.33
CDK4 P11802 2/20 0.33
CCND1 P24385 2/20 0.33
CCNE1 P24864 2/20 0.33
CDK2 P24941 2/20 0.33
MAPT P10636 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
GAA P10253 1/20 0.32
CRH P06850 1/20 0.32
PPARA Q07869 2/20 0.30

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
SCHEMBL7432763 0.81 NOS3 (0.33) CRHR1NOS3NOS2GAA
SCHEMBL7436122 0.70 KDM4E (0.38) CRHR1CDK4CCND1CCNE1CDK2
SCHEMBL7438391 0.69 CDK2 (0.40) CRHR1CCNE1CDK2MAPTNOS3
SCHEMBL25313165 0.69 ACKR3 (0.38) CRHR1MAPT
SCHEMBL12953210 0.68 GSK3B (0.52) CDK2MAPT
SCHEMBL13304696 0.68 KDM4E (0.36) CRHR1MAPT
SCHEMBL25465520 0.67 MAPT (0.36) MAPT
SCHEMBL21189850 0.66 KDM4E (0.45) MAPT
SCHEMBL7443554 0.66 KDM4E (0.35) CRHR1CDK2MAPT
SCHEMBL15549960 0.63 MAPT (0.47) CRHR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628559-B1 Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF LILLY GMBH (DE) 2002-04-03 EP disclosed
US-5602136-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5602137-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5571813-A Fused pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1996-11-05 US disclosed
EP-0628559-A1 Pyrimidine compounds and their use as pharmaceuticals Beiersdorf-Lilly GmbH (DE) 1994-12-14 EP disclosed