SCHEMBL7006901

SCHEMBL7006901

Cn1c(=O)c2c(C(=O)N3CCC3)c(Cc3nc4ccccc4n3C)sc2n(CC2CC2)c1=O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 19/20 0.59
CYP2C9 P11712 11/20 0.59
CYP3A4 P08684 7/20 0.59
SLC16A7 O60669 1/20 0.47
PDE10A Q9Y233 1/20 0.40

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
SCHEMBL7008494 0.82 SLC16A1 (0.52) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL7008632 0.75 BRD4 (0.41) CYP3A4PDE10A
SCHEMBL4806131 0.70 SLC16A1 (0.60) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL7010063 0.70 SLC16A1 (0.69) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5864658 0.68 SLC16A1 (0.75) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL4797275 0.68 SLC16A1 (0.58) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL6353017 0.68 SLC16A1 (0.63) SLC16A1CYP2C9CYP3A4
SCHEMBL14163907 0.68 SLC16A1 (0.54) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL7004524 0.68 LMNA (0.40) SLC16A1CYP2C9CYP3A4
SCHEMBL7004749 0.67 SLC16A1 (0.63) SLC16A1CYP2C9CYP3A4

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 8 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
US-6300334-B1 DRUGS FOR TREATMENT OF RESPIRATORY SYSTEM DISORDERS ASTRAZENECA AB (SE) 2001-10-09 US 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