SCHEMBL14114776

SCHEMBL14114776

COc1ccc(S(=O)(=O)OC(C)C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 4/20 0.57
▸ MMP13 P45452 6/20 0.49
▸ MMP1 P03956 4/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ CA1 P00915 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ MMP2 P08253 1/20 0.48
▸ MMP9 P14780 1/20 0.48
▸ MMP8 P22894 1/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ PKLR P30613 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ TUBB4A P04350 1/20 0.45
▸ TUBB P07437 1/20 0.45
▸ TUBA3C P0DPH7 1/20 0.45

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
SCHEMBL143705 0.79 GAA (0.50) PKMMMP13MMP1LMNAHTT
SCHEMBL10709306 0.79 CES2 (0.50) MMP13LMNAHTTSMN1; SMN2TDP1
SCHEMBL10763646 0.79 PKM (0.67) PKMMMP13MMP1LMNAHTT
SCHEMBL8198936 0.79 PKM (0.67) PKMMMP13MMP1LMNAHTT
SCHEMBL10811773 0.78 TDP1 (0.56) LMNAHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL10823195 0.78 TSHR (0.48) PKMMMP13MMP1LMNASMN1; SMN2
SCHEMBL19788267 0.78 ALDH1A1 (0.36) PKMMMP13MMP1CA1CA2
Ammonia Solution, Strong SCHEMBL5917791 0.78 GAA (0.48) PKMMMP13MMP1LMNAHTT
SCHEMBL19949926 0.78 GAA (0.48) PKMMMP13MMP1LMNAHTT
SCHEMBL18853809 0.78 CA2 (0.45) MMP13MMP1LMNACA1CA2

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-117623838-A Chiral sulfoxide ester compound and preparation method thereof 贵州大学 2024-03-01 — — CN disclosed
US-20080176862-A1 Cognitive impairment, Alzheimer disease, neurodegeneration, dementia; such as 3'-(2-amino-4-(2-chloropyridin-4-yl)-1-methyl-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-5-chlorobiphenyl-3-yl methanesulfonate; Beta site APP Cleaving Enzyme (BACE) inhibitors ASTRAZENECA AB (SE) 2008-07-24 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080176862-A1 Cognitive impairment, Alzheimer disease, neurodegeneration, dementia; such as 3'-(2-amino-4-(2-chloropyridin-4-yl)-1-methyl-5-oxo-4,5-dihydro-1H-imidazol-4-yl)-5-chlorobiphenyl-3-yl methanesulfonate; Beta site APP Cleaving Enzyme (BACE) inhibitors BACE1, BACE2, PSEN1 PKM 2928/4885MMP13 953/4885MMP1 737/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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