SCHEMBL6155141

SCHEMBL6155141

CC(C)(O)CCCCc1ccc(/C=C/c2ccc(O)c(CO)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.43
MMP9 P14780 2/20 0.43
MMP8 P22894 2/20 0.43
NFKB1 P19838 1/20 0.43
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
KLF10 Q13118 1/20 0.40
HMGCR P04035 1/20 0.39
MMP13 P45452 1/20 0.38
ALOX5 P09917 1/20 0.37
IGF1R P08069 4/20 0.36
ALOX15 P16050 4/20 0.36
MET P08581 2/20 0.36
IAPP P10997 1/20 0.36
AKR1B10 O60218 1/20 0.35
AKR1B1 P15121 1/20 0.35
AKR1C3 P42330 1/20 0.35
SPHK2 Q9NRA0 1/20 0.35
SPHK1 Q9NYA1 1/20 0.35
ADRB2 P07550 2/20 0.35

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
SCHEMBL6155147 1.00 MMP2 (0.43) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6155863 0.99 MMP2 (0.42) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6155861 0.99 MMP2 (0.42) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6154891 0.90 HMGCR (0.39) PTGS1PTGS2HMGCRALOX5IGF1R
SCHEMBL6154895 0.90 HMGCR (0.39) PTGS1PTGS2HMGCRALOX5IGF1R
SCHEMBL6155533 0.90 HMGCR (0.41) PTGS1PTGS2HMGCRALOX5AKR1C3
SCHEMBL6155531 0.90 HMGCR (0.41) PTGS1PTGS2HMGCRALOX5AKR1C3
SCHEMBL6155530 0.89 HMGCR (0.52) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL6155538 0.89 HMGCR (0.52) MMP2MMP9MMP8NFKB1PTGS1
SCHEMBL2107463 0.88 HMGCR (0.40) PTGS1PTGS2HMGCRAKR1C3SPHK2

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