SCHEMBL10424324

SCHEMBL10424324

CCOC(=O)C1=C(C(C)C)Nc2onc(C)c2C1c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 5/20 0.47
CACNA1D Q01668 5/20 0.47
CACNA1S Q13698 5/20 0.47
CACNA1C Q13936 5/20 0.47
ACHE P22303 1/20 0.47
KDM4E B2RXH2 3/20 0.44
LMNA P02545 3/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ABCC1 P33527 1/20 0.43
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
BCHE P06276 1/20 0.42
MTOR P42345 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.39
ABCB1 P08183 1/20 0.39

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
SCHEMBL10460249 0.85 CACNA1F (0.38) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL2647704 0.84 CACNA1F (0.56) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL2662903 0.81 CACNA1F (0.50) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL10518334 0.81 ACHE (0.43) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL27310185 0.80 CACNA1F (0.52) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL2648819 0.79 CACNA1F (0.70) CACNA1FCACNA1DCACNA1SCACNA1CKDM4E
SCHEMBL8949808 0.79 CACNA1D (0.51) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL8949895 0.77 CACNA1D (0.49) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL9229958 0.76 CACNA1F (0.59) CACNA1FCACNA1DCACNA1SCACNA1CACHE
SCHEMBL8949606 0.76 CACNA1F (0.48) 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
EP-0369323-A1 Isoxazolopyridine type mevalonolactones NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-05-23 EP disclosed