SCHEMBL9376554

SCHEMBL9376554

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ HPGD P15428 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ TSPO P30536 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ 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
SCHEMBL9368682 0.88 NLRP3 (0.40) NLRP3TDP1SMN1; SMN2CA12CA1
SCHEMBL9373264 0.86 NLRP3 (0.37) NLRP3TDP1SMN1; SMN2CA12CA1
SCHEMBL9371281 0.85 TDP1 (0.39) NLRP3TDP1SMN1; SMN2CA12CA1
SCHEMBL9481107 0.80 NLRP3 (0.40) NLRP3TDP1SMN1; SMN2MAPTNPC1
SCHEMBL9369583 0.78 NLRP3 (0.40) NLRP3SMN1; SMN2CA12CA1CA2
SCHEMBL9372436 0.77 NLRP3 (0.43) NLRP3SMN1; SMN2CA12CA1CA2
SCHEMBL9368764 0.77 NLRP3 (0.33) NLRP3TDP1SMN1; SMN2CA12CA1
SCHEMBL9374168 0.76 NLRP3 (0.40) NLRP3SMN1; SMN2CA12CA1CA2
SCHEMBL9371953 0.75 NLRP3 (0.35) NLRP3TDP1SMN1; SMN2L3MBTL1HPGD
SCHEMBL9376548 0.75 NLRP3 (0.39) NLRP3SMN1; SMN2L3MBTL1ALDH1A1KDM4E

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
EP-0377893-B1 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1994-04-06 — — EP disclosed
US-5186737-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1993-02-16 — — US disclosed
US-5045560-A Insecticides, nematocides, fungicides, herbicides, human and veterinary medicine BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 — — US disclosed
EP-0377893-A2 3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1990-07-18 — — EP disclosed
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