SCHEMBL18040211

SCHEMBL18040211

O=C(O)c1ccc(C23CC4CC(CC(C4)C2)C3)c(O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.45
RARG P13631 6/20 0.45
RARA P10276 6/20 0.45
SELL P14151 1/20 0.44
SELP P16109 1/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
THRB P10828 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL31373806 0.85 LMNA (0.45) RARBRARGRARAMEN1KMT2A
SCHEMBL4309684 0.85 KDM4E (0.46) RARBRARGRARAMEN1KMT2A
SCHEMBL548996 0.84 MEN1 (0.48) RARBRARGRARAMEN1KMT2A
SCHEMBL15766044 0.79 SELL (0.47) RARBRARGRARASELLSELP
SCHEMBL8144795 0.78 RARG (0.40) RARBRARGRARAMEN1KMT2A
SCHEMBL8132446 0.78 NPC1 (0.41) RARBRARGRARAMEN1KMT2A
SCHEMBL8149907 0.77 KDM4E (0.45) RARBRARGRARAKDM4EEPHX2
SCHEMBL3768061 0.77 MEN1 (0.52) RARBRARGRARAMEN1KMT2A
SCHEMBL27780757 0.76 NPC1 (0.40) RARBRARGRARAMEN1KMT2A
SCHEMBL5475249 0.76 KDM4E (0.53) RARBRARGRARAMEN1KMT2A

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
CN-107427431-B Antioxidant or anti-aging composition comprising 5-adamantan-1-yl-N- (2, 4-dihydroxybenzyl) -2, 4-dimethoxybenzamide 株式会社爱茉莉太平洋 2021-04-13 CN disclosed
US-9433593-B1 Composition for anti-inflammation containing 5-adamantan-1-yl-N-(2,4-dihydroxy-benzyl)-2,4-dimethoxy-benzamide AMOREPACIFIC CORPORATION (KR) 2016-09-06 US disclosed