SCHEMBL4811066

SCHEMBL4811066

CC(=O)NN1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 10/20 0.64
LMNA P02545 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
MCOLN3 Q8TDD5 3/20 0.61
TSHR P16473 1/20 0.61
PABPC1 P11940 1/20 0.60
APOBEC3A P31941 1/20 0.60
EIF4H Q15056 1/20 0.60
APOBEC3G Q9HC16 1/20 0.60
HTT P42858 1/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
RAB9A P51151 1/20 0.60
ALDH1A1 P00352 1/20 0.59
GAA P10253 1/20 0.59
CTDSP1 Q9GZU7 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58

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
SCHEMBL4810006 0.88 PKM (0.67) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL4810002 0.84 PKM (0.61) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL18134604 0.84 MCOLN3 (0.83) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL18711449 0.83 PKM (0.74) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL15014129 0.80 PKM (0.89) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL1662361 0.79 MAPT (0.74) PKMLMNASMN1; SMN2TSHRHTT
SCHEMBL3169939 0.78 MCOLN3 (0.97) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL18702168 0.77 PKM (0.69) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL13151736 0.77 PKM (0.71) PKMLMNASMN1; SMN2MCOLN3TSHR
SCHEMBL9951645 0.77 PKM (0.72) PKMLMNASMN1; SMN2HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7345043-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS (US) 2008-03-18 US disclosed
US-20050250784-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-11-10 US disclosed
US-20050234033-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS 2005-10-20 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 (2 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-20050250784-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 PKM 1811/4885LMNA 1419/4885SMN1; SMN2 2387/4885
US-20050234033-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 PKM 1811/4885LMNA 1419/4885SMN1; SMN2 2387/4885

“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.