SCHEMBL11018659

SCHEMBL11018659

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.55
▸ ANPEP P15144 3/20 0.55
▸ POLB P06746 1/20 0.44
▸ HTT P42858 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ TYMS P04818 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPK10 P53779 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PTK2B Q14289 1/20 0.39
▸ NCOA1 Q15788 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL11020066 0.93 DPP4 (0.64) DPP4ANPEPPOLBHTTKDM4E
SCHEMBL11019249 0.88 DPP4 (0.55) DPP4ANPEPALDH1A1NR1H2NR1H3
SCHEMBL11017325 0.87 DPP4 (0.54) DPP4ANPEPALDH1A1NR1H2NR1H3
SCHEMBL11022208 0.87 DPP4 (0.59) DPP4ANPEPALDH1A1NR1H2NR1H3
SCHEMBL11020653 0.86 DPP4 (0.53) DPP4ANPEPPOLBHTTKDM4E
SCHEMBL11016792 0.86 DPP4 (0.55) DPP4ANPEPALDH1A1HPGDNR1H2
SCHEMBL11020131 0.86 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11018644 0.86 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11017664 0.84 ANPEP (0.52) DPP4ANPEPPOLBHTTALDH1A1
SCHEMBL11019712 0.84 ANPEP (0.52) DPP4ANPEPPOLBHTTALDH1A1

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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