SCHEMBL11022221

SCHEMBL11022221

COC(=O)c1c(C)ccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.56
▸ ANPEP P15144 6/20 0.56
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35

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
SCHEMBL11021715 0.86 DPP4 (0.52) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11023192 0.85 DPP4 (0.51) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018924 0.85 DPP4 (0.59) DPP4ANPEPNR1H2NR1H3
SCHEMBL11021909 0.84 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11020920 0.82 ANPEP (0.47) DPP4ANPEP
SCHEMBL11020066 0.81 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019578 0.81 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018659 0.80 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019005 0.80 DPP4 (0.68) DPP4ANPEPNR1H2NR1H3CA1
SCHEMBL11019374 0.78 ANPEP (0.50) DPP4ANPEPNR1H2NR1H3KDM4E

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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