SCHEMBL11017755

SCHEMBL11017755

CCc1cccc(CC)c1N1C(=O)c2cccc(C(=O)NOC)c2C1=O

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.62
▸ ANPEP P15144 3/20 0.62
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ TYMS P04818 3/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HPGD P15428 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ PABPC1 P11940 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
SCHEMBL11022176 0.86 DPP4 (0.63) DPP4ANPEPCRHBPCRHR2ALOX15
SCHEMBL11022233 0.86 DPP4 (0.63) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11017209 0.86 DPP4 (0.63) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11017426 0.83 DPP4 (0.66) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11021201 0.83 DPP4 (0.59) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11021547 0.82 DPP4 (0.63) DPP4ANPEPTYMSKMT2A
SCHEMBL11022146 0.82 DPP4 (0.68) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11020126 0.81 ANPEP (0.56) DPP4ANPEPCRHBPCRHR2ALOX15
SCHEMBL11021799 0.81 POLB (0.57) DPP4ANPEPCRHBPCRHR2TYMS
SCHEMBL11018014 0.81 DPP4 (0.56) DPP4ANPEPCRHBPCRHR2TYMS

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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