SCHEMBL6565100

SCHEMBL6565100

CCC(CC)(CCC=C(C)c1cc(COc2ccc(C(=O)O)c(C(=O)O)c2)cs1)O[Si](CC)(CC)CC

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.32
MAOA P21397 2/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PPARG P37231 1/20 0.30
PPARD Q03181 1/20 0.30
PPARA Q07869 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
SCHEMBL6565090 1.00 MAOB (0.32) MAOBMAOAMAPTHTTL3MBTL1
SCHEMBL6564886 0.91 MAOB (0.32) MAOBMAOAMAPTHTTL3MBTL1
SCHEMBL6564880 0.91 MAOB (0.32) MAOBMAOAMAPTHTTL3MBTL1
SCHEMBL6887145 0.90 ALOX5AP (0.33) MAOBMAOA
SCHEMBL6887141 0.90 ALOX5AP (0.33) MAOBMAOA
SCHEMBL6562982 0.86 MAOB (0.35) MAOBMAOAMAPTHTTL3MBTL1
SCHEMBL6562992 0.86 MAOB (0.35) MAOBMAOAMAPTHTTL3MBTL1
SCHEMBL6562805 0.85 MRGPRX4 (0.31)
SCHEMBL6562808 0.85 MRGPRX4 (0.31)
SCHEMBL6566263 0.84 DAO (0.30)

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-1235824-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-05-19 EP disclosed
US-6706725-B1 BIAROMATIC COMPOUNDS WHICH ARE VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-03-16 US disclosed
EP-1235824-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038320-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed