SCHEMBL6562856

SCHEMBL6562856

OCc1ccc(OCc2cc(Br)cs2)cc1CO

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGMT P16455 4/20 0.35
MAOB P27338 10/20 0.33
MAOA P21397 5/20 0.33
VDR P11473 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL6563887 0.74 MGMT (0.35) MGMT
SCHEMBL6564253 0.74 ALDH1A1 (0.43) MAOBMAOA
SCHEMBL6562790 0.71 VDR (0.36) VDR
SCHEMBL6562780 0.71 VDR (0.36) VDR
SCHEMBL6562782 0.71 VDR (0.36) VDR
SCHEMBL29958389 0.71 RAB9A (0.47) MGMTMAOBMAOA
SCHEMBL6564935 0.71 VDR (0.41) VDR
SCHEMBL7608665 0.71 VDR (0.42) MAOBVDR
SCHEMBL6883547 0.71 MAOB (0.43) MAOBMAOA
SCHEMBL6566504 0.70 VDR (0.50) VDR

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