SCHEMBL22012068

SCHEMBL22012068

CC(C)(C)[Si](C)(C)NS(=O)(=O)c1ccc(CN2CCC2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HTT P42858 1/20 0.46
CHKA P35790 3/20 0.42
PIK3CA P42336 3/20 0.40
PIK3CD O00329 1/20 0.40
PIK3R1 P27986 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
HTR6 P50406 2/20 0.39
SCN8A Q9UQD0 4/20 0.39
SCN1A P35498 3/20 0.39
SCN5A Q14524 3/20 0.39
SCN1B Q07699 2/20 0.39
KCNH2 Q12809 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
SCN9A Q15858 1/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL21893271 0.79 PIK3CA (0.37) ALDH1A1PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL25033941 0.77 MEN1 (0.35) SCN8ASCN1ASCN5ASCN9AMEN1
SCHEMBL22013625 0.77 HRH3 (0.39) ALDH1A1SCN8ASCN1ASCN5AKCNH2
SCHEMBL21962724 0.76 ALDH1A1 (0.44) ALDH1A1HTTCHKAHTR6SCN8A
SCHEMBL21962847 0.74 ALDH1A1 (0.57) ALDH1A1HTTCHKAHTR6POLB
SCHEMBL22013636 0.73 NMT1 (0.52) KMT2A
SCHEMBL20680929 0.71 NMT1 (0.36) POLB
SCHEMBL20692403 0.71 SCN3A (0.38) KCNH2
SCHEMBL4101414 0.69 ALDH1A1 (0.89) ALDH1A1HTTCHKAPOLBKDM4E
SCHEMBL22012683 0.68 AKR1C3 (0.35)

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 1999/4885HTT 2668/4885CHKA 4097/4885

“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.