SCHEMBL19822053

SCHEMBL19822053

CCC(C)(C)OC(=O)CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
CA2 P00918 1/20 0.34
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.32
ALOX15 P16050 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MIF P14174 1/20 0.31
MMP8 P22894 1/20 0.31

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
SCHEMBL22773968 0.83 MMP1 (0.37) MMP1MMP2MMP3MMP9MMP13
SCHEMBL18534234 0.83 CYP2D6 (0.33) CYP2D6ALDH1A1TDP1TSHR
SCHEMBL19821795 0.82 CYP2D6 (0.33) CYP2D6ALDH1A1TDP1TSHR
SCHEMBL3423225 0.80 CYP2D6 (0.32) CYP2D6
SCHEMBL22773967 0.80 MMP1 (0.35) MMP1MMP2MMP3MMP9MMP13
SCHEMBL23281608 0.80 MMP1 (0.41) MMP1MMP2MMP3MMP9MMP13
SCHEMBL2690899 0.79 CYP2D6 (0.55) MMP1MMP2MMP3MMP9MMP13
SCHEMBL9743655 0.79 CYP2D6 (0.33) CYP2D6ALDH1A1TDP1TSHRHDAC3
SCHEMBL19066062 0.79 MMP1 (0.37) MMP1MMP2MMP3MMP9MMP13
SCHEMBL17878584 0.79 CA1 (0.40) ALDH1A1TDP1TSHR

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
US-11773266-B2 Polymer, molded body, foam, resin composition, and production method for polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-03 US disclosed
US-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
US-20180030175-A1 POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed