SCHEMBL8170458

SCHEMBL8170458

C=CC(=O)NCO.C=CC(=O)OCCCC

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.71
HPGD P15428 1/20 0.71
ALDH1A1 P00352 5/20 0.52
CYP3A4 P08684 1/20 0.52
ATM Q13315 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.49
ZDHHC2 Q9UIJ5 1/20 0.49
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HCAR2 Q8TDS4 3/20 0.45
TP53 P04637 2/20 0.43
HIF1A Q16665 2/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 2/20 0.41
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACHE P22303 4/20 0.38

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
Acrylonitrile SCHEMBL194986 0.92 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL8414717 0.89 TSHR (0.56) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL423336 0.85 ZDHHC20 (0.53) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL5788357 0.84 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4ATM
Alcohol SCHEMBL17821478 0.84 TSHR (0.92) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL15037 0.84
SCHEMBL5681395 0.84 TSHR (1.00) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL1330627 0.84
SCHEMBL1331857 0.84
SCHEMBL11582291 0.84 TSHR (1.00) TSHRHPGDALDH1A1CYP3A4ATM

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
CN-113555558-B Emulsion type binder and lithium ion battery comprising same 珠海冠宇电池股份有限公司 2022-12-20 CN claimed
CN-113555558-A Emulsion type binder and lithium ion battery comprising same 珠海冠宇电池股份有限公司 2021-10-26 CN claimed
CN-106085071-A A kind of non-orientation silicon steel coatings and preparation method thereof 湖北武洲新材料科技有限公司 2016-11-09 CN claimed
CN-113555558-A Emulsion type binder and lithium ion battery comprising same 珠海冠宇电池股份有限公司 2021-10-26 CN disclosed
US-6140038-A Heat-developable image-recording material FUJI PHOTO FILM CO., LTD (JP) 2000-10-31 US disclosed