SCHEMBL11021904

SCHEMBL11021904

COC(=O)CNC(=O)c1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.55
▸ ANPEP P15144 5/20 0.55
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ KEAP1 Q14145 1/20 0.41
▸ POLB P06746 2/20 0.40
▸ TYMS P04818 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPT P10636 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
SCHEMBL11020754 0.89 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11019064 0.89 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11021879 0.88 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11021927 0.87 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018535 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11018111 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11022122 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3KEAP1
SCHEMBL11021547 0.84 DPP4 (0.63) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019780 0.84 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11017368 0.84 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3POLB

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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