SCHEMBL11018124

SCHEMBL11018124

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

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.55
▸ ANPEP P15144 4/20 0.55
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ TYMS P04818 2/20 0.44
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ FABP3 P05413 1/20 0.41
▸ FABP4 P15090 1/20 0.41
▸ POLB P06746 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
SCHEMBL11018380 0.90 DPP4 (0.55) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL10878219 0.90 DPP4 (0.68) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11018319 0.89 DPP4 (0.54) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11021557 0.89 DPP4 (0.54) DPP4ANPEPCTDSP1TYMSNR1H2
Ammonia Solution, Strong SCHEMBL11017800 0.88 DPP4 (0.67) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11017664 0.87 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3ALDH1A1
SCHEMBL11016971 0.87 DPP4 (0.52) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11022208 0.82 DPP4 (0.59) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11018662 0.82 DPP4 (0.58) DPP4ANPEPCTDSP1TYMSNR1H2
SCHEMBL11018280 0.81 DPP4 (0.56) DPP4ANPEPCTDSP1TYMSNR1H2

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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