SCHEMBL11019781

SCHEMBL11019781

CCc1cc(CC)c(N2C(=O)c3cccc(C(=O)O)c3C2=O)c(CC)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.54
▸ ANPEP P15144 3/20 0.54
▸ CTDSP1 Q9GZU7 1/20 0.48
▸ TYMS P04818 2/20 0.44
▸ POLB P06746 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ALOX15 P16050 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ PIM3 Q86V86 1/20 0.37
▸ HIPK4 Q8NE63 1/20 0.37
▸ SCN2A Q99250 1/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ MYC P01106 1/20 0.36

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
SCHEMBL11019088 0.90 DPP4 (0.54) DPP4ANPEPCTDSP1TYMSPOLB
SCHEMBL11022146 0.89 DPP4 (0.68) DPP4ANPEPCTDSP1TYMSPOLB
SCHEMBL11019967 0.89 DPP4 (0.53) DPP4ANPEPCTDSP1TYMSL3MBTL1
SCHEMBL11018731 0.89 DPP4 (0.53) DPP4ANPEPCTDSP1TYMSLMNA
SCHEMBL11019298 0.88 DPP4 (0.52) DPP4ANPEPCTDSP1POLBALDH1A1
SCHEMBL11019263 0.84 DPP4 (0.60) DPP4ANPEPCTDSP1TYMSPOLB
SCHEMBL11018296 0.83 DPP4 (0.56) DPP4ANPEPCTDSP1TYMSPOLB
SCHEMBL11019037 0.81 DPP4 (0.56) DPP4ANPEPCTDSP1TYMSPOLB
SCHEMBL11018217 0.80 DPP4 (0.54) DPP4ANPEPCTDSP1TYMSALDH1A1
SCHEMBL11018280 0.79 DPP4 (0.56) DPP4ANPEPCTDSP1TYMSALDH1A1

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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