SCHEMBL24323901

SCHEMBL24323901

NCCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.66
ALDH1A1 P00352 5/20 0.66
KMT2A Q03164 3/20 0.66
PKM P14618 7/20 0.64
NPC1 O15118 1/20 0.64
LMNA P02545 1/20 0.64
ATM Q13315 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57

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
SCHEMBL3768578 0.89 PKM (0.70) GAAALDH1A1KMT2APKMNPC1
SCHEMBL17029140 0.85 POLB (0.72) GAAALDH1A1KMT2APKMNPC1
SCHEMBL24322686 0.84 MEN1 (0.59) GAAALDH1A1KMT2APKMLMNA
SCHEMBL24323815 0.84 PKM (0.67) GAAALDH1A1KMT2APKMNPC1
SCHEMBL30754632 0.83 ALDH1A1 (0.68) GAAALDH1A1KMT2APKMNPC1
SCHEMBL20300422 0.83 PKM (0.71) GAAALDH1A1KMT2APKMNPC1
SCHEMBL12518923 0.83 GAA (0.72) GAAALDH1A1KMT2APKMNPC1
SCHEMBL10722317 0.82 GAA (0.62) GAAALDH1A1KMT2APKMNPC1
SCHEMBL6744239 0.80 ALDH1A1 (0.71) GAAALDH1A1KMT2APKMNPC1
SCHEMBL28784026 0.79 ALDH1A1 (0.69) GAAALDH1A1KMT2APKMNPC1

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
US-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN GAA 1981/4885ALDH1A1 4556/4885KMT2A 3149/4885

“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.