SCHEMBL22012109

SCHEMBL22012109

CC(C)(O)c1cncc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 2/20 0.34
PIK3CA P42336 2/20 0.34
SLC40A1 Q9NP59 1/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
CYP11B2 P19099 12/20 0.33
CYP11B1 P15538 10/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
SLC22A11 Q9NSA0 1/20 0.32
MTOR P42345 1/20 0.32
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
AR P10275 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
SCHEMBL22012922 0.86 PSEN1 (0.32) ALDH1A1POLBHTTSMN1; SMN2
SCHEMBL25067022 0.81 NLRP3 (0.46) SLC40A1ALDH1A1SMN1; SMN2AR
SCHEMBL24978417 0.80 ALDH1A1 (0.43) CYP3A4ALDH1A1POLBHTTSMN1; SMN2
SCHEMBL22021481 0.77 PIK3CA (0.46) PIK3R1PIK3CAPIK3C3CYP11B2CYP11B1
SCHEMBL22012132 0.76 CYP11B2 (0.33) CYP11B2SLC22A12
SCHEMBL22012108 0.76 CYP11B2 (0.37) PIK3R1PIK3CACYP11B2CYP11B1ALDH1A1
SCHEMBL22012105 0.76 APLNR (0.55) PIK3R1PIK3CACYP11B2CYP11B1MTOR
SCHEMBL21963211 0.74 APLNR (0.35) PIK3R1PIK3CACYP11B2CYP11B1MTOR
SCHEMBL22012107 0.74 CYP11B2 (0.32) PIK3R1PIK3CACYP11B2CYP11B1
SCHEMBL22265271 0.73 NLRP3 (0.48)

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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
US-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 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 (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-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 PIK3R1 3797/4885PIK3CA 3440/4885SLC40A1 784/4885
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 PIK3R1 3782/4885PIK3CA 3199/4885SLC40A1 934/4885

“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.