SCHEMBL11021713

SCHEMBL11021713

CC(C)COC(=O)Cc1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.56
▸ ANPEP P15144 5/20 0.56
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ PLA2G1B P04054 1/20 0.42
▸ ATG4B Q9Y4P1 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ NPY1R P25929 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
SCHEMBL11020782 0.90 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3HPGD
SCHEMBL11023185 0.88 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3HSD17B10
SCHEMBL11022219 0.87 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3KDM4E
SCHEMBL11020916 0.84 DPP4 (0.51) DPP4ANPEPNR1H2NR1H3
SCHEMBL11021686 0.83 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11018921 0.82 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11019207 0.82 DPP4 (0.58) DPP4ANPEPNR1H2NR1H3PLA2G1B
SCHEMBL11016230 0.81 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3PLA2G1B
SCHEMBL11018532 0.81 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3PLA2G1B
SCHEMBL11019003 0.80 DPP4 (0.68) DPP4ANPEPNR1H2NR1H3KMT2A

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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