SCHEMBL21287906

SCHEMBL21287906

CC(C)(C)N1CC2CN(S(C)(=O)=O)CC2C1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
PAX8 Q06710 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL21287991 0.86 TP53 (0.37) ATMTP53
SCHEMBL23919067 0.82 ATM (0.41) ATM
SCHEMBL9611097 0.82 ATM (0.41) ATM
SCHEMBL24411869 0.82 ATM (0.41) ATM
SCHEMBL17281982 0.76 ATM (0.31) ATM
SCHEMBL14306372 0.75 PAX8 (0.33) PAX8TP53
SCHEMBL10201701 0.74 ELANE (0.34)
SCHEMBL19771070 0.74 ATM (0.37) ATM
SCHEMBL14306357 0.73 PAX8 (0.32) PAX8TP53
SCHEMBL680281 0.73 LMNA (0.39) ATMTP53

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
US-20220110933-A1 METHODS OF TREATING DISEASE WITH MAGL INHIBITORS H. LUNDBECK A/S (DK) 2022-04-14 US disclosed
US-20190256494-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2019-08-22 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-20220110933-A1 METHODS OF TREATING DISEASE WITH MAGL INHIBITORS MGLL, LIPA, PNLIP ATM 4018/4885PAX8 3391/4885TP53 4550/4885
US-20190256494-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, ABHD16A, RABL6 ATM 3258/4885PAX8 2691/4885TP53 4105/4885

“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.