SCHEMBL6155861

SCHEMBL6155861

CC(C)(O)CCCCCc1ccc(/C=C/c2ccc(O)c(CO)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.42
MMP9 P14780 2/20 0.42
MMP8 P22894 2/20 0.42
NFKB1 P19838 1/20 0.42
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
KLF10 Q13118 1/20 0.39
HMGCR P04035 1/20 0.39
MMP13 P45452 1/20 0.38
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ALOX5 P09917 1/20 0.37
VDR P11473 1/20 0.36
CYP24A1 Q07973 1/20 0.36
MET P08581 2/20 0.35
IGF1R P08069 1/20 0.35
ALOX15 P16050 1/20 0.35
IAPP P10997 1/20 0.35
CDK1 P06493 1/20 0.35
AKR1B10 O60218 1/20 0.34

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
SCHEMBL6155863 1.00 MMP2 (0.42) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6155141 0.99 MMP2 (0.43) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6155147 0.99 MMP2 (0.43) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL2107466 0.90 HMGCR (0.40) PTGS1PTGS2HMGCRVDRCYP24A1
SCHEMBL2107463 0.90 HMGCR (0.40) PTGS1PTGS2HMGCRVDRCYP24A1
SCHEMBL6156460 0.89 HMGCR (0.51) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6156462 0.89 HMGCR (0.51) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6154895 0.89 HMGCR (0.39) PTGS1PTGS2HMGCRALOX5VDR
SCHEMBL6154891 0.89 HMGCR (0.39) PTGS1PTGS2HMGCRALOX5VDR
SCHEMBL6155531 0.88 HMGCR (0.41) PTGS1PTGS2HMGCRALOX5VDR

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 6 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 claimed
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 claimed
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