SCHEMBL6155451

SCHEMBL6155451

CCN(C(=O)CCC(C)=O)c1cccc(C(C)(C)C)c1O[SiH](C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6155412 0.87 NLRP3 (0.33) NLRP3
SCHEMBL6879527 0.72 NPSR1 (0.37)
SCHEMBL12679901 0.69 CYP3A4 (0.55) SMN1; SMN2
SCHEMBL2676114 0.69 NR1H4 (0.38) NLRP3
SCHEMBL3235703 0.69 NR1H4 (0.43)
SCHEMBL4677041 0.68 CA2 (0.38) NLRP3
SCHEMBL9370172 0.68 NR1H4 (0.39) NLRP3
SCHEMBL2545343 0.67 MEN1 (0.42) NLRP3
SCHEMBL2989103 0.67 ALDH1A1 (0.41)
SCHEMBL8700619 0.67 CA2 (0.33) NLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed