SCHEMBL11018222

SCHEMBL11018222

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.49
▸ ANPEP P15144 5/20 0.49
▸ 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
▸ HSP90AB1 P08238 1/20 0.33
▸ KEAP1 Q14145 1/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ TYMS P04818 1/20 0.31
▸ JUN P05412 1/20 0.30

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) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11018036 0.89 DPP4 (0.49) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11020926 0.87 DPP4 (0.47) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11019024 0.87 DPP4 (0.47) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11017007 0.85 DPP4 (0.47) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11017671 0.85 DPP4 (0.67) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11018358 0.83 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3ALOX15
SCHEMBL11019283 0.81 DPP4 (0.44) DPP4ANPEPALOX15MAPK1HSD17B10
SCHEMBL11020131 0.81 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11019613 0.79 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1

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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