SCHEMBL22013637

SCHEMBL22013637

CC(C)(C)OC(=O)N1CCC[C@@H]1c1ccc(S(N)(=O)=N[Si](C)(C)C(C)(C)C)s1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TSHR P16473 6/20 0.38
LMNA P02545 4/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
NPC1 O15118 1/20 0.36
USP30 Q70CQ3 1/20 0.35

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
SCHEMBL22012905 1.00 ALDH1A1 (0.39) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL22012909 0.85 MEN1 (0.41) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL21962786 0.85 MEN1 (0.41) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL22012903 0.85 MEN1 (0.41) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL22012904 0.80 NPC1 (0.41) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL22012885 0.76 NR1H2 (0.40) KMT2AMEN1
SCHEMBL22012882 0.76 NR1H2 (0.40) KMT2AMEN1
SCHEMBL657228 0.74 NPC1 (0.43) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL657227 0.74 NPC1 (0.43) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL15240571 0.73 UCHL1 (0.46) ALDH1A1TSHRLMNAKMT2AMEN1

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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
WO-2020102576-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 WO 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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 ALDH1A1 1999/4885TSHR 4306/4885LMNA 1759/4885

“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.