SCHEMBL11019423

SCHEMBL11019423

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.53
▸ ANPEP P15144 5/20 0.53
▸ ALDH1A1 P00352 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ NR1H2 P55055 1/20 0.41
▸ NR1H3 Q13133 1/20 0.41
▸ KDM5B Q9UGL1 1/20 0.41
▸ POLR1A O95602 1/20 0.41
▸ KEAP1 Q14145 1/20 0.37
▸ SIGMAR1 Q99720 1/20 0.36
▸ BCHE P06276 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ DRD4 P21917 1/20 0.36

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
SCHEMBL11022122 0.87 DPP4 (0.57) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11018535 0.87 DPP4 (0.57) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11018446 0.87 DPP4 (0.52) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11018669 0.86 DPP4 (0.56) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11018631 0.86 DPP4 (0.56) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11021879 0.86 DPP4 (0.61) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11021927 0.85 DPP4 (0.55) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11019064 0.85 DPP4 (0.60) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11018040 0.84 DPP4 (0.54) DPP4ANPEPALDH1A1HTTPOLB
SCHEMBL11016780 0.84 DPP4 (0.54) DPP4ANPEPALDH1A1HTTPOLB

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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