Sugi Predict

Sugi Predict / Compounds / SCHEMBL11262343

SCHEMBL11262343

SCHEMBL11262343

CCCCCCOC(=O)C1=C(C)NN=C(c2ccccc2)C1c1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 11/20 0.51
▸ CACNA1F O60840 6/20 0.50
▸ CACNA1D Q01668 6/20 0.50
▸ CACNA1S Q13698 6/20 0.50
▸ CACNA1C Q13936 6/20 0.50

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
SCHEMBL11254571 0.84 CACNA1B (0.47) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11257667 0.80 ADORA3 (0.57) CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11256475 0.79 SLC6A3 (0.47) CACNA1B
SCHEMBL11261733 0.79 CACNA1F (0.50) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11259253 0.79 SLC6A3 (0.46) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11392503 0.77 CACNA1B (0.53) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11389848 0.76 CACNA1B (0.50) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL27412226 0.76 CACNA1B (0.61) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL11262288 0.75 CACNA1F (0.50) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL7047706 0.74 CACNA1F (0.66) CACNA1BCACNA1FCACNA1DCACNA1SCACNA1C

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