SCHEMBL22282173

SCHEMBL22282173

C[C@@H]1Cc2cc3c(c(N)c2C1)CCC3

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ACHE P22303 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
BPTF Q12830 1/20 0.31
MAPT P10636 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
SCHEMBL20692058 1.00 MEN1 (0.31) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL30042038 1.00 MEN1 (0.31) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL6231710 0.80 ACHE (0.42) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL23691685 0.79 MAPT (0.33) MAPT
SCHEMBL21626228 0.79 MEN1 (0.31) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL23674334 0.79 MEN1 (0.31) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL23674373 0.79 MEN1 (0.31) MEN1ACHEMAPK1KMT2ABPTF
SCHEMBL23691688 0.78 NLRP3 (0.31) MAPT
SCHEMBL23674527 0.78 NLRP3 (0.33)
SCHEMBL25796524 0.78 NLRP3 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020154499-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 WO disclosed