SCHEMBL4066822

SCHEMBL4066822

C=COCC1CCC(COC(C)=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
LMNA P02545 2/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
NLRP3 Q96P20 2/20 0.32

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
SCHEMBL278690 0.84 ALDH1A1 (0.49) LMNATHRATHRBALDH1A1
SCHEMBL6256094 0.84
SCHEMBL5696892 0.84 ALDH1A1 (0.43) JAK2JAK1TYK2JAK3LMNA
SCHEMBL17029138 0.84 ALDH1A1 (0.43) JAK2JAK1TYK2JAK3LMNA
SCHEMBL5676446 0.83 JAK2 (0.34) JAK2JAK1TYK2JAK3LMNA
SCHEMBL2526794 0.81 LMNA (0.51) LMNAALDH1A1
SCHEMBL9180809 0.81 LMNA (0.33) LMNA
SCHEMBL9180814 0.81 LMNA (0.33) LMNA
SCHEMBL278984 0.81 TSHR (0.39) LMNATHRATHRBALDH1A1HSD17B10
SCHEMBL23177333 0.81 TSHR (0.41) JAK2JAK1TYK2JAK3LMNA

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
US-8785582-B2 Vinylozy group-containing vinyl polymer NIPPON CARBIDE INDUSTRIES CO., LTD. (JP) 2014-07-22 US claimed
US-20130245189-A1 VINYLOZY GROUP-CONTAINING VINYL POLYMER NIPPON CARBIDE INDUSTRIES CO., INC. (JP) 2013-09-19 US claimed
US-8785582-B2 Vinylozy group-containing vinyl polymer NIPPON CARBIDE INDUSTRIES CO., LTD. (JP) 2014-07-22 US disclosed
US-20130245189-A1 VINYLOZY GROUP-CONTAINING VINYL POLYMER NIPPON CARBIDE INDUSTRIES CO., INC. (JP) 2013-09-19 US disclosed
JP-2009096836-A 1-ACETOXYMETHYL-4-CYCLOHEXYLMETHYL VINYL ETHER NIPPON CARBIDE IND CO INC 2009-05-07 JP disclosed