SCHEMBL9372436

SCHEMBL9372436

CCOC(=O)CN(CC)C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 2/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ TSPO P30536 4/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MGAM O43451 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ SI P14410 1/20 0.34
▸ MGAM2 Q2M2H8 1/20 0.34

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
SCHEMBL9481206 0.89 HPGD (0.40) NLRP3SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL9369583 0.85 NLRP3 (0.40) NLRP3SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL9374168 0.85 NLRP3 (0.40) NLRP3SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL9372688 0.84 F2 (0.40) NLRP3SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL9376548 0.84 NLRP3 (0.39) NLRP3SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9373260 0.82 ITGB1 (0.39) NLRP3SMN1; SMN2ALDH1A1
SCHEMBL9368665 0.82 PIN1 (0.47) SMN1; SMN2KMT2AMEN1LMNATSPO
SCHEMBL9368524 0.82 NLRP3 (0.37) NLRP3SMN1; SMN2HPGDCA12CA1
SCHEMBL2167246 0.81 NLRP3 (0.51) NLRP3SMN1; SMN2HPGDKMT2ALMNA
SCHEMBL9368775 0.81 NLRP3 (0.40) NLRP3SMN1; SMN2HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0377893-B1 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1994-04-06 — — EP disclosed
EP-0377893-A2 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1990-07-18 — — EP disclosed
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