SCHEMBL3280559

SCHEMBL3280559

CCC(O)c1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
AOC3 Q16853 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 4/20 0.38
CA1 P00915 4/20 0.38
CA9 Q16790 4/20 0.38
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL6781597 0.88 PNMT (0.48) LMNAAOC3L3MBTL1CA12CA1
SCHEMBL30737358 0.83 AOC3 (0.38) AOC3L3MBTL1CA12CA1CA9
SCHEMBL343105 0.83 CA12 (0.40) AOC3L3MBTL1CA12CA1CA9
SCHEMBL7301978 0.81 LMNA (0.44) LMNAAOC3CA12CA1CA9
SCHEMBL15242469 0.80 CA1 (0.42) LMNACA12CA1CA9HSP90AA1
SCHEMBL9643548 0.79 ALOX5 (0.39) AOC3L3MBTL1CA12CA1CA9
SCHEMBL6055237 0.78 LMNA (0.48) LMNAAOC3L3MBTL1CHRM2CHRM1
SCHEMBL19745616 0.78 CA12 (0.41) L3MBTL1CA12CA1CA9HSP90AA1
SCHEMBL8076860 0.78 CA12 (0.37) CA12CA1CA9HSP90AA1HSP90AB1
SCHEMBL7477920 0.78 MMP8 (0.42) L3MBTL1CA12CA1CA9HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700657-B2 Vitamin D analogs GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-04-20 US disclosed
EP-1395538-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2009-12-30 EP disclosed
US-20040224929-A1 Novel vitamin D analogs GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-11-11 US disclosed
EP-1395538-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-03-10 EP disclosed
WO-2002094754-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2002-11-28 WO disclosed