SCHEMBL11261733

SCHEMBL11261733

CCCCCCC1=NNC(C)=C(C(=O)OCC)C1c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 9/20 0.50
CACNA1D Q01668 9/20 0.50
CACNA1S Q13698 9/20 0.50
CACNA1C Q13936 9/20 0.50
ACHE P22303 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CACNA1B Q00975 8/20 0.44
ABCC1 P33527 1/20 0.44

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
SCHEMBL11262288 0.88 CACNA1F (0.50) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL11267928 0.86 NR3C2 (0.43) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL11392503 0.81 CACNA1B (0.53) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL11261753 0.81 HIF1A (0.44) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL11386854 0.80 CACNA1B (0.50) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL11262343 0.79 CACNA1B (0.51) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL3026966 0.78 ABCC1 (0.71) CACNA1FCACNA1DCACNA1SCACNA1CADORA3
SCHEMBL11389848 0.77 CACNA1B (0.50) CACNA1FCACNA1DCACNA1SCACNA1CCACNA1B
SCHEMBL11260210 0.76 CACNA1F (0.66) CACNA1FCACNA1DCACNA1SCACNA1CADORA3
SCHEMBL11386624 0.76 CACNA1B (0.46) CACNA1FCACNA1DCACNA1SCACNA1CACHE

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
US-4360520-A 1,4-Dihydropyridazine compounds, and their medicinal use BAYER AKTIENGESELLSCHAFT (DE) 1982-11-23 US disclosed