SCHEMBL27680429

SCHEMBL27680429

COC(C(=O)c1ccccc1)=C(OC)c1cc(OC)c(OC)c(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
ALDH1A1 P00352 6/20 0.46
CYP1A2 P05177 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
GFER P55789 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 2/20 0.43
GAA P10253 1/20 0.43
TNFRSF1A P19438 1/20 0.43
KDM4E B2RXH2 2/20 0.43
HTT P42858 2/20 0.42
MITF O75030 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL27660465 0.88 ALDH1A1 (0.48) ATMALDH1A1CYP1A2MEN1KMT2A
SCHEMBL27888962 0.84 CES2 (0.51) ATMALDH1A1CYP1A2MEN1KMT2A
SCHEMBL27660424 0.82 NPC1 (0.49) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL2137968 0.78 MAPT (0.58) ATMALDH1A1CYP1A2KMT2AMAPT
Hydrochloric Acid SCHEMBL27462903 0.77 MAPT (0.56) ATMALDH1A1CYP1A2KMT2AMAPT
SCHEMBL27987526 0.76 ALDH1A1 (0.62) ATMALDH1A1CYP1A2MEN1KMT2A
SCHEMBL29625356 0.76 TSHR (0.52) ATMKMT2AMAPTSMN1; SMN2HPGD
SCHEMBL5056144 0.74 CES2 (0.44) ATMALDH1A1CYP1A2MEN1KMT2A
SCHEMBL31219445 0.73 ALDH1A1 (0.44) ATMALDH1A1CYP1A2MEN1KMT2A
SCHEMBL27888985 0.72 MAPT (0.51) ALDH1A1CYP1A2MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1990482-A Flavanonol compounds and their production method and use ZHEJIANG HISUN NATURELITE PHAR (CN) 2007-07-04 CN claimed
CN-1990482-B Flavanonol compounds and their production method and use ZHEJIANG HISUN PHARM CO LTD 2010-12-08 CN disclosed
CN-1990482-A Flavanonol compounds and their production method and use ZHEJIANG HISUN NATURELITE PHAR (CN) 2007-07-04 CN disclosed