SCHEMBL2488020

SCHEMBL2488020

CCCC(C)c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.48
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
HIF1A Q16665 1/20 0.42
ABCB11 O95342 1/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
AOC3 Q16853 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
SCHEMBL30421518 1.00 UGT2B7 (0.48) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL11051116 0.94 UGT2B7 (0.55) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL6888083 0.89 UGT2B7 (0.46) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL14612063 0.87 UGT2B7 (0.41) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL2491242 0.85 UGT2B7 (0.52) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL8979859 0.81 UGT2B7 (0.49) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL10581782 0.81 UGT2B7 (0.49) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL10583499 0.81 UGT2B7 (0.49) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL10580009 0.81 UGT2B7 (0.49) UGT2B7MEN1CYP1A2CYP2D6TSHR
SCHEMBL10583623 0.81 UGT2B7 (0.49) UGT2B7MEN1CYP1A2CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116135830-B Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2024-10-18 CN disclosed
CN-116135830-A Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2023-05-19 CN disclosed
CN-110511130-A A method of purifying 2- tertiary pentyl anthraquinone from the mixture of both 2- amylanthraquinone and 2- tertiary pentyl anthraquinone UNIV TIANJIN 2019-11-29 CN disclosed
EP-2173731-B1 METHOD FOR PRODUCING PROPYLENE OXIDE SUMITOMO CHEMICAL CO (JP) 2011-10-26 EP disclosed
EP-2173731-A2 METHOD FOR PRODUCING PROPYLENE OXIDE Sumitomo Chemical Company, Limited (JP) 2010-04-14 EP disclosed
WO-2009008493-A2 METHOD FOR PRODUCING PROPYLENE OXIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 WO disclosed