SCHEMBL11018319

SCHEMBL11018319

CC(C)c1cc(C(C)C)c(N2C(=O)c3cccc(C(=O)Cl)c3C2=O)c(C(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.54
▸ ANPEP P15144 5/20 0.54
▸ NR1H2 P55055 1/20 0.41
▸ NR1H3 Q13133 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ TYMS P04818 2/20 0.36
▸ FABP3 P05413 1/20 0.34
▸ FABP4 P15090 1/20 0.34

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
SCHEMBL11019613 0.91 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11017671 0.90 DPP4 (0.67) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11018124 0.89 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11021557 0.88 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11017664 0.86 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3
SCHEMBL11016971 0.86 DPP4 (0.52) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11020131 0.83 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11018380 0.81 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11018358 0.81 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11019712 0.79 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3

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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