SCHEMBL28012009

SCHEMBL28012009

CCCCC(Cc1ccc(O)c(C(C)(C)C)c1C(C)(C)C)(C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.39
ESR2 Q92731 3/20 0.39
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.35
POLB P06746 2/20 0.35
CYP3A4 P08684 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
ALOX15 P16050 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
EGFR P00533 1/20 0.35
FYN P06241 1/20 0.35
APEX1 P27695 1/20 0.35
ADRA1A P35348 1/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL7048035 0.75
SCHEMBL9074096 0.74 TYR (0.50) ESR1ESR2KDM4EALDH1A1CYP3A4
SCHEMBL2040206 0.73 GABRA1 (0.43) ESR1ESR2ALDH1A1HPGDALOX15
SCHEMBL11495521 0.71 TYR (0.56) ESR1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL816624 0.71 TYR (0.56) ESR1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL27880027 0.71 TYR (0.56) ESR1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL27548329 0.71 PTPN1 (0.40) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL1719554 0.70 NR5A2 (0.48) ESR1ESR2ALDH1A1CYP1A2CYP3A4
SCHEMBL9847378 0.70 GRIK1 (0.41) MAPTGAAMAPK1XBP1ATM
SCHEMBL1487540 0.70 BLM (0.51) ESR1ESR2KDM4EALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101650451-B Light conducting plate SUMITOMO CHEMICAL CO 2015-04-29 CN disclosed