SCHEMBL11018141

SCHEMBL11018141

CCOC(=O)Nc1c(C)ccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 7/20 0.52
▸ ANPEP P15144 5/20 0.51
▸ DPP4 P27487 5/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ RAB9A P51151 1/20 0.39
▸ NR1H2 P55055 1/20 0.39
▸ NR1H3 Q13133 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ POLB P06746 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
SCHEMBL11019374 0.84 ANPEP (0.50) NLRP3ANPEPDPP4MAPK1RAB9A
SCHEMBL11018135 0.79 DPP4 (0.54) NLRP3ANPEPDPP4MAPK1NR1H2
SCHEMBL11023192 0.77 DPP4 (0.51) ANPEPDPP4MAPK1NR1H2NR1H3
SCHEMBL11018073 0.77 DPP4 (0.60) ANPEPDPP4MAPK1RAB9ANR1H2
SCHEMBL11018560 0.77 DPP4 (0.53) ANPEPDPP4NR1H2NR1H3
SCHEMBL11022221 0.77 DPP4 (0.56) ANPEPDPP4NR1H2NR1H3KDM4E
SCHEMBL11019005 0.75 DPP4 (0.68) ANPEPDPP4NR1H2NR1H3
SCHEMBL11021715 0.75 DPP4 (0.52) ANPEPDPP4RAB9ANR1H2NR1H3
SCHEMBL11020782 0.75 DPP4 (0.57) NLRP3ANPEPDPP4NR1H2NR1H3
SCHEMBL11018545 0.75 DPP4 (0.57) ANPEPDPP4NR1H2NR1H3POLB

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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