SCHEMBL7007181

SCHEMBL7007181

CC(C)Cn1c(=O)n(C)c(=O)c2c(Br)c(C(=O)c3cccnc3)sc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 18/20 0.40
CYP2C9 P11712 8/20 0.40
CYP3A4 P08684 6/20 0.40
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
CAMK2B Q13554 1/20 0.39
HIPK4 Q8NE63 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SLC16A7 O60669 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
SCHEMBL7008546 0.86 SLC16A1 (0.49) SLC16A1CYP2C9CYP3A4CCNA2CDK2
SCHEMBL7009668 0.83 SLC16A1 (0.55) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL7005966 0.82 SLC16A1 (0.40) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL7011900 0.79 SLC16A1 (0.40) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL6637503 0.78 SLC16A1 (0.55) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL7007940 0.77 SLC16A1 (0.49) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL6637125 0.76 SLC16A1 (0.55) SLC16A1CYP2C9CYP3A4
SCHEMBL6639761 0.76 SLC16A1 (0.41) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL6721654 0.75 SLC16A1 (0.71) SLC16A1CYP2C9CYP3A4
SCHEMBL19759436 0.70 SLC16A1 (0.41) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B

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 4 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 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