SCHEMBL5968356

SCHEMBL5968356

OCc1ccc(CCc2cc[c]cc2)cc1CO

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.37
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
LTA4H P09960 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TYR P14679 1/20 0.32
CHKA P35790 1/20 0.32
ALOX5 P09917 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
BACE1 P56817 1/20 0.31
DAO P14920 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL5871273 0.77 KDM4E (0.52) VDRKDM4EALDH1A1TYRALOX5
SCHEMBL29366879 0.74 EGFR (0.47) VDRKDM4EHSD17B10MAPTEGFR
SCHEMBL63126 0.74 EGFR (0.47) VDRKDM4EHSD17B10MAPTEGFR
SCHEMBL15471726 0.74 BACE1 (0.53) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL13953779 0.74 CNR1 (0.50) VDRTYRALOX5MAPTBACE1
SCHEMBL6576818 0.73 GFER (0.40) ESR1ESR2LTA4HALDH1A1HPGD
SCHEMBL18199330 0.71 TYR (0.48) VDRESR1KDM4EALDH1A1HPGD
SCHEMBL6756665 0.70 VDR (0.47) VDRALOX5DAO
SCHEMBL4405623 0.70 ESR1 (0.70) ESR1ESR2LTA4HKDM4EALDH1A1
SCHEMBL241799 0.69

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1686972-A1 SPRAYABLE COMPOSITION FOR THE ADMINISTRATION OF VITAMIN D DERIVATIVES Galderma Research & Development, S.N.C. (FR) 2006-08-09 EP disclosed
WO-2005053666-A1 SPRAYABLE COMPOSITION FOR THE ADMINISTRATION OF VITAMIN D DERIVATIVES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 WO disclosed