SCHEMBL22019716

SCHEMBL22019716

CC(C)(C)c1c2c(nc3c1CCC3(C)C)CCC2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
MEN1 O00255 1/20 0.32
ACHE P22303 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
BPTF Q12830 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL24978079 0.84 USP2 (0.32) USP2MEN1ACHEMAPK1KMT2A
SCHEMBL22019939 0.84 USP2 (0.33) USP2MEN1ACHEMAPK1KMT2A
SCHEMBL22019995 0.78 ACHE (0.48) USP2MEN1ACHEMAPK1KMT2A
SCHEMBL22019717 0.78 KDM4E (0.36) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL30120892 0.77 ACHE (0.55) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL22019942 0.77 ACHE (0.55) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL22020511 0.77 MEN1 (0.52) USP2MEN1ACHEMAPK1KMT2A
SCHEMBL24478599 0.75 GAA (0.34) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL24871670 0.75 ACHE (0.45) USP2MEN1ACHEMAPK1KMT2A
SCHEMBL24977975 0.74 EEF2K (0.34) MEN1ACHEMAPK1KMT2ABPTF

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-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
US-20230011652-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-01-12 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 (3 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 4117/4885MEN1 3390/4885ACHE 4177/4885
US-20230011652-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 USP2 4161/4885MEN1 3418/4885ACHE 4292/4885
US-20230063462-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 USP2 3121/4885MEN1 2868/4885ACHE 4656/4885

“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.