SCHEMBL11022103

SCHEMBL11022103

COc1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.66
▸ ANPEP P15144 5/20 0.66
▸ NR1H2 P55055 1/20 0.54
▸ NR1H3 Q13133 1/20 0.54
▸ TOP1 P11387 1/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ DUSP3 P51452 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ FGB P02675 1/20 0.40
▸ THRB P10828 1/20 0.40

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
SCHEMBL11019616 0.83 DPP4 (0.66) DPP4ANPEPNR1H2NR1H3ALDH1A1
SCHEMBL11017723 0.82 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11018078 0.81 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3ADORA2A
SCHEMBL11016604 0.81 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3
SCHEMBL5014222 0.80 ANPEP (0.55) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11020664 0.80 ANPEP (0.52) DPP4ANPEPKMT2APOLBMAPK1
SCHEMBL2820118 0.80 DPP4 (0.78) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL29366407 0.80 DPP4 (0.78) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11017030 0.80 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3ADORA2A
SCHEMBL9812593 0.79 DPP4 (0.69) DPP4ANPEPNR1H2NR1H3

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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