SCHEMBL11016509

SCHEMBL11016509

CCc1cccc(C(C)C)c1N1C(=O)c2cccc(C(N)=O)c2C1=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.55
▸ ANPEP P15144 6/20 0.55
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ KEAP1 Q14145 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41
▸ PARP1 P09874 4/20 0.40
▸ PARP2 Q9UGN5 4/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37

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
SCHEMBL11019928 0.90 DPP4 (0.67) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018280 0.89 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3LMNA
SCHEMBL11017426 0.89 DPP4 (0.66) DPP4ANPEPKEAP1NFE2L2PARP1
SCHEMBL11018358 0.88 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CRHBP
SCHEMBL11020653 0.86 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3HTT
SCHEMBL11018629 0.86 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3CRHBP
SCHEMBL11018644 0.86 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018426 0.83 DPP4 (0.59) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018036 0.83 DPP4 (0.49) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018476 0.83 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3CRHBP

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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