SCHEMBL11021915

SCHEMBL11021915

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)N(C)CCO)c2C1=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.56
▸ ANPEP P15144 5/20 0.56
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ USP1 O94782 2/20 0.38
▸ P2RX3 P56373 2/20 0.37
▸ KEAP1 Q14145 2/20 0.37
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL11018546 0.90 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018110 0.87 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11020637 0.84 DPP4 (0.58) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018282 0.84 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018786 0.83 DPP4 (0.50) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11020758 0.83 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018112 0.81 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11021906 0.80 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11016787 0.80 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL10878219 0.80 DPP4 (0.68) DPP4ANPEPNR1H2NR1H3ALDH1A1

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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