SCHEMBL11018036

SCHEMBL11018036

CCCc1c(C(C)C)ccc(C(C)C)c1N1C(=O)c2cccc(C(N)=O)c2C1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.49
▸ ANPEP P15144 5/20 0.49
▸ PARP1 P09874 4/20 0.39
▸ PARP2 Q9UGN5 4/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ NR1H2 P55055 1/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ ALOX15 P16050 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HSD17B10 Q99714 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
SCHEMBL11022218 0.90 DPP4 (0.50) DPP4ANPEPLMNANR1H2NR1H3
SCHEMBL11018222 0.89 DPP4 (0.49) DPP4ANPEPKEAP1NR1H2NR1H3
SCHEMBL11019024 0.87 DPP4 (0.47) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11020926 0.87 DPP4 (0.47) DPP4ANPEPHTTNR1H2NR1H3
SCHEMBL11019928 0.85 DPP4 (0.67) DPP4ANPEPPARP1PARP2KEAP1
SCHEMBL11016509 0.83 DPP4 (0.55) DPP4ANPEPPARP1PARP2LMNA
SCHEMBL11018004 0.81 DPP4 (0.47) DPP4ANPEPPARP1PARP2LMNA
SCHEMBL11018644 0.81 DPP4 (0.57) DPP4ANPEPPARP1KEAP1NFE2L2
SCHEMBL11021557 0.78 DPP4 (0.54) DPP4ANPEPPARP1KEAP1NFE2L2
SCHEMBL11018426 0.78 DPP4 (0.59) DPP4ANPEPPARP1PARP2LMNA

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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