SCHEMBL6156636

SCHEMBL6156636

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

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.46
NR4A2 P43354 4/20 0.44
SMPD1 P17405 1/20 0.44
NR4A1 P22736 1/20 0.44
NR4A3 Q92570 1/20 0.44
PTPN1 P18031 1/20 0.44
MAOA P21397 2/20 0.43
FFAR1 O14842 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL6156524 0.85 NR4A1 (0.41) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6157101 0.84 VDR (0.41) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6156629 0.83 VDR (0.55) MAOBNR4A2NR4A1NR4A3PTPN1
SCHEMBL6156634 0.83 VDR (0.55) MAOBNR4A2NR4A1NR4A3PTPN1
SCHEMBL6156640 0.83 VDR (0.55) MAOBNR4A2NR4A1NR4A3PTPN1
SCHEMBL6154767 0.81 VDR (0.42) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6156762 0.76 VDR (0.45) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6154679 0.76 VDR (0.46) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6155253 0.74 VDR (0.47) MAOBNR4A2SMPD1NR4A1NR4A3
SCHEMBL6155866 0.74 MAOB (0.43) MAOBNR4A2SMPD1NR4A1NR4A3

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 4 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 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