SCHEMBL6155468

SCHEMBL6155468

CCC(O)(CC)CCCC(C)c1ccc(OCc2ccc(C(O)O)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
HSP90AA1 P07900 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
BCHE P06276 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
FFAR1 O14842 4/20 0.38
ALOX5 P09917 2/20 0.38
PPARG P37231 1/20 0.36

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
SCHEMBL2106608 0.87 MRGPRX4 (0.42) FFAR1ALOX5
SCHEMBL2785504 0.87 CYSLTR2 (0.40) BCHEMEN1KMT2AALDH1A1TSHR
SCHEMBL6155616 0.85 ALOX5 (0.39) BCHEMEN1KMT2AALDH1A1TSHR
SCHEMBL6155510 0.84 MAPK1 (0.39) BCHEMEN1KMT2AALDH1A1TSHR
SCHEMBL6155463 0.82 VDR (0.44) NPC1RAB9ARXRARXRBHSP90AA1
SCHEMBL6155146 0.81 NPC1 (0.47) NPC1RAB9ARXRARXRBHSP90AA1
SCHEMBL6886818 0.79 NPC1 (0.48) NPC1RAB9ARXRARXRBHSP90AA1
SCHEMBL5968372 0.78 PTGER3 (0.41) BCHEMEN1KMT2AALDH1A1TSHR
SCHEMBL6155587 0.75 CYSLTR2 (0.44) BCHEMEN1KMT2AFFAR1ALOX5
SCHEMBL2107789 0.75 MRGPRX4 (0.44) BCHEFFAR1ALOX5

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