SCHEMBL11018047

SCHEMBL11018047

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)Oc3ccccn3)c2C1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.53
▸ ANPEP P15144 5/20 0.53
▸ NR1H2 P55055 1/20 0.44
▸ NR1H3 Q13133 1/20 0.44
▸ NPC1 O15118 1/20 0.36
▸ GRM5 P41594 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ GRM4 Q14833 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HCRTR1 O43613 1/20 0.33
▸ HCRTR2 O43614 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
SCHEMBL11017998 0.88 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11018523 0.84 DPP4 (0.58) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11020066 0.81 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11018019 0.81 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11017723 0.81 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11018175 0.81 DPP4 (0.50) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11018286 0.80 DPP4 (0.52) DPP4ANPEPNR1H2NR1H3ALDH1A1
SCHEMBL11016343 0.80 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11020213 0.79 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3NPC1
SCHEMBL11017139 0.79 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3NPC1

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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