SCHEMBL22019941

SCHEMBL22019941

CC1(C)Cc2nc3c(c(C(C)(C)C)c2C1)CCC3

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.37
ACHE P22303 2/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
BPTF Q12830 1/20 0.36
ALOX15 P16050 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.31
GAA P10253 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NUDT1 P36639 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
SCHEMBL22019995 0.84 ACHE (0.48) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL24978782 0.82 MAPT (0.34) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL22020511 0.82 MEN1 (0.52) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL24871670 0.80 ACHE (0.45) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL22020038 0.76 ACHE (0.62) ACHEMEN1MAPK1KMT2ABPTF
SCHEMBL25085444 0.73 NPSR1 (0.37) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL22019967 0.73 ACHE (0.36) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL22019716 0.72 USP2 (0.33) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL24871669 0.71 USP2 (0.33) USP2ACHEMEN1MAPK1KMT2A
SCHEMBL22019719 0.70 USP2 (0.37) USP2ACHEMEN1MAPK1KMT2A

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-20230063462-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-03-02 US disclosed
US-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 US disclosed
WO-2020102096-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 USP2 4117/4885ACHE 4177/4885MEN1 3390/4885
US-20230063462-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 USP2 3121/4885ACHE 4656/4885MEN1 2868/4885

“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.