SCHEMBL29694577

SCHEMBL29694577

CC(C)(C)C(CCCCCOC(N)=O)(OC(N)=O)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 3/20 0.36
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
CHRNB2 P17787 2/20 0.36
CHRNA4 P43681 2/20 0.36
HTR1A P08908 1/20 0.36
CYP2C19 P33261 1/20 0.36
CHRNA7 P36544 1/20 0.36
ALOX15 P16050 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
NAAA Q02083 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL5831644 0.82 LMNA (0.39) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL28904971 0.80 ALOX15 (0.44) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL28525251 0.80 ALOX15 (0.44) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL29163515 0.80 ALOX15 (0.44) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL11287294 0.77 ALOX15 (0.46) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL9547590 0.76 ALOX15 (0.38) LMNAHSD17B10TSHRCHRM2CHRM4
SCHEMBL5721317 0.74 TSHR (0.50) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL2059697 0.74 TSHR (0.50) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL31296577 0.74 TSHR (0.50) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL2136691 0.74 TSHR (0.50) LMNATSHRCHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109476866-B Method for producing thermally expandable material SIKA技术股份公司 2022-05-31 CN claimed
CN-109476866-B Method for producing thermally expandable material SIKA技术股份公司 2022-05-31 CN disclosed