SCHEMBL6157101

SCHEMBL6157101

CCCC(=CCCC(O)(CC)CC)c1cccc(OCc2ccc(C(O)O)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.41
SMPD1 P17405 1/20 0.39
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 1/20 0.38
F2 P00734 2/20 0.38
MAOB P27338 6/20 0.38
MAOA P21397 2/20 0.37

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
SCHEMBL6154679 0.92 VDR (0.46) VDRSMPD1NR4A1NR4A2NR4A3
SCHEMBL6156524 0.91 NR4A1 (0.41) VDRSMPD1NR4A1NR4A2NR4A3
SCHEMBL2783957 0.87 MAOB (0.42) VDRSMPD1NR4A1NR4A2NR4A3
SCHEMBL6156636 0.84 MAOB (0.46) SMPD1NR4A1NR4A2NR4A3MAOB
SCHEMBL6157093 0.83 VDR (0.60) VDRNR4A1NR4A2NR4A3F2
SCHEMBL6157106 0.83 VDR (0.60) VDRNR4A1NR4A2NR4A3F2
SCHEMBL6157097 0.83 VDR (0.60) VDRNR4A1NR4A2NR4A3F2
SCHEMBL6154767 0.83 VDR (0.42) VDRSMPD1NR4A1NR4A2NR4A3
SCHEMBL6156762 0.83 VDR (0.45) VDRSMPD1NR4A1NR4A2NR4A3
SCHEMBL2783369 0.82 MRGPRX4 (0.44) VDR

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