SCHEMBL3346537

SCHEMBL3346537

C[Si](C)(C)C#CC1=CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
MAPK1 P28482 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
SCHEMBL18530722 0.71 CYP1A2 (0.49) DRD2DRD4DRD3
SCHEMBL14812101 0.70
SCHEMBL30858320 0.67 GRM5 (0.53) DRD2DRD4DRD3MAPK1
SCHEMBL3346917 0.67 DRD2 (0.39) DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL2290775 0.65 GRM5 (0.51) DRD2DRD4DRD3MAPK1
SCHEMBL91423 0.61
SCHEMBL6919917 0.61
SCHEMBL4517248 0.61 PIK3CD (0.34)
SCHEMBL2290995 0.61 GRM5 (0.44) DRD2DRD4DRD3
SCHEMBL31558715 0.60 GRM5 (0.43) DRD2DRD4DRD3

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
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO disclosed