SCHEMBL29129028

SCHEMBL29129028

COC(=O)CCCCCCCCCC(S)CCCCCCCCC(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 4/20 0.50
ALDH1A1 P00352 1/20 0.50
PABPC1 P11940 1/20 0.44
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
KMT2A Q03164 1/20 0.42
PPARG P37231 2/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.39
EPHX2 P34913 2/20 0.39
PPARA Q07869 1/20 0.39
HPGD P15428 1/20 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
SCHEMBL15954875 1.00 TSHR (0.56) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL8416314 0.93 LMNA (0.50) TSHRL3MBTL1LMNAALDH1A1PPARG
SCHEMBL18681871 0.93 LMNA (0.50) TSHRL3MBTL1LMNAALDH1A1PPARG
SCHEMBL17173340 0.93 LMNA (0.50) TSHRL3MBTL1LMNAALDH1A1PPARG
SCHEMBL17173344 0.91 PPARG (0.49) TSHRL3MBTL1LMNAALDH1A1PPARG
SCHEMBL7778506 0.90 TSHR (0.50) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL8104827 0.89 TSHR (0.48) TSHRL3MBTL1LMNAALDH1A1PABPC1
SCHEMBL8897102 0.85 ZDHHC7 (0.47) TSHRL3MBTL1LMNAKMT2APPARG
SCHEMBL3502791 0.82 TSHR (0.82) TSHRL3MBTL1LMNAALDH1A1KMT2A
SCHEMBL3503395 0.82 TSHR (0.82) TSHRL3MBTL1LMNAALDH1A1KMT2A

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-115785331-A Preparation method and application of acrylate emulsion 万华化学集团股份有限公司 2023-03-14 CN disclosed