SCHEMBL28843103

SCHEMBL28843103

C[N+](C)(C)CCOS(=O)(=O)c1ccccc1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 3/20 0.43
▸ CHRM1 P11229 3/20 0.43
▸ CHRM3 P20309 3/20 0.43
▸ CHRM2 P08172 2/20 0.43
▸ ACHE P22303 2/20 0.38
▸ SCN1A P35498 2/20 0.37
▸ SCN2A Q99250 2/20 0.37
▸ SCN3A Q9NY46 2/20 0.37
▸ MYC P01106 1/20 0.36
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ APOBEC3A P31941 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ CHRNB4 P30926 1/20 0.33
▸ CHRNA3 P32297 1/20 0.33
▸ CHRNA7 P36544 1/20 0.33
▸ CHRNA10 Q9GZZ6 1/20 0.33
▸ CHRNA9 Q9UGM1 1/20 0.33
▸ F2 P00734 4/20 0.33
▸ ESR1 P03372 1/20 0.33

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
SCHEMBL10643515 0.82 GAA (0.39) CHRM4CHRM1CHRM3CHRM2ACHE
SCHEMBL31236623 0.78 TSHR (0.43) TSHR
SCHEMBL16044696 0.78 MYC (0.41) MYCTSHRSMN1; SMN2APOBEC3AAPOBEC3G
SCHEMBL9118978 0.78 SCN1A (0.46) CHRM4CHRM1CHRM3CHRM2ACHE
SCHEMBL8613683 0.76 TSHR (0.44) CHRM2TSHR
SCHEMBL31550979 0.76 TSHR (0.44) CHRM2TSHR
SCHEMBL28766690 0.76 TSHR (0.44) CHRM2TSHR
Ammonia Solution, Strong SCHEMBL30109020 0.75 TSHR (0.43) CHRM2TSHR
Zinc Ion SCHEMBL31255855 0.74 TSHR (0.42) TSHR
SCHEMBL1645477 0.73 NSD2 (0.39) CHRM4CHRM1CHRM3CHRM2SCN1A

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-119193249-A Detergent composition and method for cleaning surface 埃科莱布美国股份有限公司 2024-12-27 — — CN disclosed
CN-115052961-A Synergistic effect of amylase and oxygen bleach in warewashing applications 埃科莱布美国股份有限公司 2022-09-13 — — CN disclosed
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