SCHEMBL5787264

SCHEMBL5787264

CON(C)C(=O)Oc1c(Cn2ccnc2SC)sc2c1c(=O)n(C)c(=O)n2CC(C)C

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 20/20 0.47
CYP2C9 P11712 9/20 0.47
CYP3A4 P08684 6/20 0.47
ABCB11 O95342 1/20 0.47
SLC16A7 O60669 1/20 0.35
MAPKAPK2 P49137 1/20 0.34
CAMK2B Q13554 1/20 0.34
HIPK4 Q8NE63 1/20 0.34

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
SCHEMBL5786581 0.90 SLC16A1 (0.40) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL5786624 0.89 SLC16A1 (0.50) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL5788286 0.89 SLC16A1 (0.52) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4803307 0.88 SLC16A1 (0.61) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4923669 0.84 SLC16A1 (0.61) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4801051 0.83 SLC16A1 (0.46) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL3833761 0.81 SLC16A1 (0.44) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4803917 0.81 SLC16A1 (0.44) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4808984 0.81 SLC16A1 (0.45) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7
SCHEMBL4797900 0.81 SLC16A1 (0.49) SLC16A1CYP2C9CYP3A4ABCB11SLC16A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1412362-B1 THIENO¬2,3-d|PYRIMIDINEDIONES AS INHIBITORS OF T-CELLS PROLIFERATION ASTRAZENECA AB (SE) 2006-08-02 EP claimed