SCHEMBL6155616

SCHEMBL6155616

CCC(O)(CC)CCCCC(C)c1cccc(OCc2ccc(C(O)O)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.39
MAPK1 P28482 2/20 0.39
CYSLTR2 Q9NS75 2/20 0.39
CYSLTR1 Q9Y271 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
GMNN O75496 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39

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
SCHEMBL6155510 0.99 MAPK1 (0.39) ALOX5MAPK1CYSLTR2CYSLTR1MEN1
SCHEMBL2785504 0.98 CYSLTR2 (0.40) ALOX5MAPK1CYSLTR2CYSLTR1MEN1
SCHEMBL5968372 0.89 PTGER3 (0.41) ALOX5MAPK1CYSLTR2CYSLTR1MEN1
SCHEMBL6155248 0.88 CYSLTR2 (0.42) ALOX5MAPK1CYSLTR2CYSLTR1MEN1
SCHEMBL2106608 0.87 MRGPRX4 (0.42) ALOX5TP53NFKB1SMN1; SMN2FFAR1
SCHEMBL6155587 0.87 CYSLTR2 (0.44) ALOX5CYSLTR2CYSLTR1MEN1KMT2A
SCHEMBL6155468 0.85 NPC1 (0.42) ALOX5MEN1KMT2ATSHRALDH1A1
SCHEMBL6155609 0.85 VDR (0.48) ALOX5CYSLTR2CYSLTR1BCHEFFAR1
SCHEMBL6155503 0.84 VDR (0.47) ALOX5MAPK1CYSLTR2CYSLTR1TP53
SCHEMBL2785501 0.82 VDR (0.49) ALOX5CYSLTR2CYSLTR1BCHEFFAR1

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