SCHEMBL6154870

SCHEMBL6154870

CC1(c2cccc(COc3ccc(CO)c(CO)c3)c2)OCCO1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.44
MAOB P27338 4/20 0.40
VDR P11473 1/20 0.38
MAOA P21397 2/20 0.38

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
SCHEMBL6155882 0.79 MAOB (0.46) ALOX5MAOBMAOA
SCHEMBL856097 0.77 OPRM1 (0.40)
SCHEMBL6884736 0.77 ALOX5 (0.45) ALOX5MAOBMAOA
SCHEMBL6155391 0.74 MAOB (0.62) MAOBMAOA
SCHEMBL8761070 0.73 ALOX5 (0.58) ALOX5MAOBMAOA
SCHEMBL27899553 0.70 TSHR (0.38)
SCHEMBL7778339 0.70 F2 (0.46) MAOBVDRMAOA
SCHEMBL855485 0.69 ALDH1A1 (0.38) ALOX5
SCHEMBL29866080 0.69 TSHR (0.39) ALOX5
SCHEMBL507495 0.69 SMN1; SMN2 (0.44)

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