SCHEMBL29287656

SCHEMBL29287656

CCCCOOC(=O)c1ccccc1CCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.53
TDP1 Q9NUW8 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
CYP3A4 P08684 3/20 0.47
MAPK1 P28482 2/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 2/20 0.47
LMNA P02545 3/20 0.46
SCN1A P35498 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN3A Q9NY46 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 0.39

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
SCHEMBL28074918 0.95 TSHR (0.51) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL5353532 0.91 TSHR (0.56) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL29024367 0.89 TSHR (0.46) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL6463491 0.89 TSHR (0.51) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL5072717 0.87 TSHR (0.68) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL1208161 0.87 TSHR (0.45) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL27825328 0.85 ALDH1A1 (0.58) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL169573 0.84 TSHR (0.75) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL6463463 0.84 TSHR (0.53) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL29024331 0.84 TSHR (0.49) TSHRTDP1L3MBTL1CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113412253-A (meth) acrylate functionalized waxes and curable compositions made therefrom 汉高知识产权控股有限责任公司 2021-09-17 CN disclosed