SCHEMBL6154690

SCHEMBL6154690

CC(C)(O)CCCCc1ccc(C=Cc2cc(O)cc(O)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 6/20 0.47
KDM4E B2RXH2 4/20 0.47
LMNA P02545 4/20 0.47
PTGS2 P35354 4/20 0.47
CYP1A1 P04798 4/20 0.47
CYP1A2 P05177 4/20 0.47
TTR P02766 4/20 0.47
CYP1B1 Q16678 3/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 3/20 0.47
TP53 P04637 3/20 0.47
CYP3A4 P08684 3/20 0.47
MAPT P10636 3/20 0.47
CYP2C9 P11712 3/20 0.47
HPGD P15428 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HIF1A Q16665 3/20 0.47
HSD17B10 Q99714 3/20 0.47
CYP19A1 P11511 3/20 0.47

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
SCHEMBL6154687 1.00 PTGS1 (0.47) PTGS1KDM4ELMNAPTGS2CYP1A1
SCHEMBL6154979 0.99 PTGS1 (0.46) PTGS1KDM4ELMNAPTGS2CYP1A1
SCHEMBL6154984 0.99 PTGS1 (0.46) PTGS1KDM4ELMNAPTGS2CYP1A1
SCHEMBL15559603 0.88 ESR1 (0.50) PTGS1KDM4ELMNAPTGS2ALDH1A1
SCHEMBL2107875 0.85 HMGCR (0.57) PTGS1KDM4EPTGS2CYP1A1CYP1A2
SCHEMBL2107876 0.85 HMGCR (0.57) PTGS1KDM4EPTGS2CYP1A1CYP1A2
SCHEMBL2106842 0.83 HMGCR (0.56) PTGS1KDM4EPTGS2TTRMEN1
SCHEMBL2106841 0.83 HMGCR (0.56) PTGS1KDM4EPTGS2TTRMEN1
SCHEMBL6155055 0.83 HMGCR (0.56) PTGS1KDM4EPTGS2TTRMEN1
SCHEMBL6155060 0.83 HMGCR (0.56) PTGS1KDM4EPTGS2TTRMEN1

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 8 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-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP claimed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO 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