SCHEMBL5717482

SCHEMBL5717482

Cc1cc(-c2cccc3c2C(c2ccc(O)c(C)c2)c2ccccc2-3)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.44
HSD17B1 P14061 6/20 0.41
HSD17B2 P37059 6/20 0.41
ESR2 Q92731 2/20 0.40
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C19 P33261 2/20 0.37
MCL1 Q07820 1/20 0.37
APP P05067 1/20 0.37
ESR1 P03372 1/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
PIM1 P11309 1/20 0.34
TYMS P04818 1/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL3465804 0.86 HSD17B1 (0.46) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL7919928 0.85 CYP3A4 (0.43) CYP3A4L3MBTL1EDNRBEDNRA
SCHEMBL918079 0.84 ESR1 (0.44) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL1372573 0.82 ALOX15 (0.45) ESR2MCL1APPESR1MEN1
SCHEMBL4631137 0.81 HSD17B1 (0.43) HSD17B1HSD17B2CYP2C19MCL1APP
SCHEMBL17045645 0.75 AKR1B1 (0.56) CYP3A4CYP2D6CYP2C19MEN1GAA
SCHEMBL8984742 0.75 MEN1 (0.47) MEN1KMT2AL3MBTL1EDNRBEDNRA
SCHEMBL573085 0.75 KMT2A (0.47) ESR2ESR1MEN1GAAKMT2A
SCHEMBL246494 0.74 TLR8 (0.40) TLR8HSD17B1HSD17B2ESR2CYP3A4
SCHEMBL1289717 0.72 CHRNB2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1671202-A2 KIOSK AND METHOD FOR DELIVERING SELECTED DIGITAL CONTENT GENERAL ELECTRIC COMPANY (US) 2006-06-21 EP disclosed
JP-2005212820-A ELECTRONIC COMPONENT TRANSFER CONTAINER TEIJIN CHEM LTD 2005-08-11 JP disclosed
WO-2005024608-A2 KIOSK AND METHOD FOR DELIVERING SELECTED DIGITAL CONTENT GENERAL ELECTRIC COMPANY (US) 2005-03-17 WO disclosed
EP-0274209-A1 Glycidylethers of fluorene-containing bisphenols MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-07-13 EP disclosed
US-4707534-A PROTECTIVE COATINGS, POLYEPOXIDES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-11-17 US disclosed