SCHEMBL6154979

SCHEMBL6154979

CC(C)(O)CCCCCc1ccc(/C=C/c2cc(O)cc(O)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 6/20 0.46
PTGS2 P35354 4/20 0.46
CYP1A1 P04798 4/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 3/20 0.46
CYP1B1 Q16678 3/20 0.46
CYP1A2 P05177 3/20 0.46
TTR P02766 3/20 0.46
CYP19A1 P11511 3/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA3 P07451 2/20 0.46
CA4 P22748 2/20 0.46
CA6 P23280 2/20 0.46
CA5A P35218 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA13 Q8N1Q1 2/20 0.46
CA14 Q9ULX7 2/20 0.46

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
SCHEMBL6154984 1.00 PTGS1 (0.46) PTGS1PTGS2CYP1A1KDM4ELMNA
SCHEMBL6154687 0.99 PTGS1 (0.47) PTGS1PTGS2CYP1A1KDM4ELMNA
SCHEMBL6154690 0.99 PTGS1 (0.47) PTGS1PTGS2CYP1A1KDM4ELMNA
SCHEMBL15559603 0.90 ESR1 (0.50) PTGS1PTGS2KDM4ELMNACA12
SCHEMBL6155055 0.85 HMGCR (0.56) PTGS1PTGS2KDM4ETTRMEN1
SCHEMBL2106841 0.85 HMGCR (0.56) PTGS1PTGS2KDM4ETTRMEN1
SCHEMBL2106842 0.85 HMGCR (0.56) PTGS1PTGS2KDM4ETTRMEN1
SCHEMBL6155060 0.85 HMGCR (0.56) PTGS1PTGS2KDM4ETTRMEN1
SCHEMBL2107876 0.83 HMGCR (0.57) PTGS1PTGS2CYP1A1KDM4ECYP1A2
SCHEMBL2107875 0.83 HMGCR (0.57) PTGS1PTGS2CYP1A1KDM4ECYP1A2

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