SCHEMBL7008632

SCHEMBL7008632

Cn1c(=O)c2cc(Cc3nc4ccccc4n3C)sc2n(CC2CC2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.41
BAZ2A Q9UIF9 2/20 0.41
GRM2 Q14416 7/20 0.39
DRD2 P14416 6/20 0.39
DRD4 P21917 6/20 0.39
PARG Q86W56 1/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
DRD3 P35462 4/20 0.39
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL7007438 0.84 SLC16A1 (0.44) LMNAKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL7005962 0.80 KMT2A (0.42) BRD4BAZ2APARGLMNAKMT2A
SCHEMBL7007892 0.80 ALDH1A1 (0.45) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL7014116 0.80 PDE2A (0.42) BRD4BAZ2APARGLMNAKMT2A
SCHEMBL7012658 0.76 ALDH1A1 (0.43) PARGLMNAKMT2AKDM4EMEN1
SCHEMBL7006901 0.75 SLC16A1 (0.59) CYP3A4PDE10A
SCHEMBL6808474 0.67 MAPK1 (0.49) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL5864675 0.67 LMNA (0.44) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL14685201 0.66 DDB1 (0.58) GRM2DRD2DRD4DDB1CRBN
SCHEMBL7008006 0.66 PARG (0.43) PARGADORA2AADORA2BLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1107973-B1 NOVEL THIENO[2,3-d]PYRIMIDINEDIONES, PROCESS FOR THEIR PREPARATION AND USE THEREOF IN THERAPY ASTRAZENECA AB (SE) 2003-11-05 EP claimed
EP-1107973-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2001-06-20 EP claimed
WO-2000012514-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-03-09 WO claimed
EP-1107973-B1 NOVEL THIENO[2,3-d]PYRIMIDINEDIONES, PROCESS FOR THEIR PREPARATION AND USE THEREOF IN THERAPY ASTRAZENECA AB (SE) 2003-11-05 EP disclosed
US-6300334-B1 DRUGS FOR TREATMENT OF RESPIRATORY SYSTEM DISORDERS ASTRAZENECA AB (SE) 2001-10-09 US disclosed
EP-1107973-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2001-06-20 EP disclosed
WO-2000012514-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-03-09 WO disclosed