SCHEMBL22280140

SCHEMBL22280140

CN(C)CCCS(N)(=O)=N[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ HTR6 P50406 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ SFRP1 Q8N474 1/20 0.31
▸ LTA4H P09960 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL22280142 0.84 — —
SCHEMBL22280042 0.77 CYP2D6 (0.32) ALDH1A1HTR2AHRH1
SCHEMBL21962897 0.74 LMNA (0.39) KDM4EALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL22265913 0.72 MCL1 (0.32) KDM4EALDH1A1LMNAHTR6POLB
SCHEMBL25014624 0.69 KCNN4 (0.35) MAPTSMN1; SMN2
SCHEMBL22280136 0.68 SFRP1 (0.33) KDM4EALDH1A1LMNAHTR2AHRH1
SCHEMBL22265836 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL22266033 0.65 NR3C2 (0.36) HTR6
SCHEMBL841940 0.62 ESR1 (0.33) ALDH1A1
SCHEMBL8928261 0.61 HTR2A (0.48) LMNAHTR2AHRH1SIGMAR1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-07-21 — — US disclosed
EP-3914583-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-12-01 — — EP disclosed
WO-2020154321-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 — — WO disclosed
WO-2020154321-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 — — 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-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 KDM4E 4520/4885ALDH1A1 2055/4885LMNA 1907/4885

“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.

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