SCHEMBL5263906

SCHEMBL5263906

COc1ncc(CC=O)s1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.49
ERN1 O75460 1/20 0.38
PDE10A Q9Y233 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
DYRK1A Q13627 1/20 0.33
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 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
SCHEMBL11971227 0.76
SCHEMBL2553787 0.75
SCHEMBL7993719 0.75
SCHEMBL3123322 0.75
SCHEMBL23146169 0.75
SCHEMBL14288617 0.73 SLC6A3 (0.44) SLC6A3ERN1PDE10AMEN1KMT2A
SCHEMBL15009379 0.72
SCHEMBL3636025 0.72
SCHEMBL5871494 0.72 SLC6A3 (0.43) SLC6A3ERN1PDE10AMEN1KMT2A
SCHEMBL4892445 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802632-A1 THIENO-PYRIMIDINE COMPOUNDS HAVING FUNGICIDAL ACTIVITY Dow AgroSciences LLC (US) 2007-07-04 EP disclosed
WO-2006047397-A1 THIENO-PYRIMIDINE COMPOUNDS HAVING FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2006-05-04 WO disclosed