SCHEMBL11018135

SCHEMBL11018135

CCOC(=O)NCc1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.54
▸ ANPEP P15144 5/20 0.54
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ NLRP3 Q96P20 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ DDB1 Q16531 2/20 0.38
▸ CRBN Q96SW2 2/20 0.38
▸ TYMS P04818 1/20 0.37
▸ KCNA5 P22460 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL11020782 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3NLRP3
SCHEMBL11019371 0.83 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3DDB1
SCHEMBL11018821 0.82 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3NLRP3
SCHEMBL11020002 0.81 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11016230 0.80 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3KDM4E
SCHEMBL11018073 0.79 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3KDM4E
SCHEMBL11018532 0.79 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3
SCHEMBL11022219 0.79 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3KDM4E
SCHEMBL11018141 0.79 NLRP3 (0.52) DPP4ANPEPNR1H2NR1H3NLRP3
SCHEMBL11018878 0.78 DPP4 (0.59) DPP4ANPEPNR1H2NR1H3DDB1

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
EP-0152021-A2 Phthalimide derivatives, their preparation and their use as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1985-08-21 — — EP disclosed
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