SCHEMBL11017209

SCHEMBL11017209

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

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.63
▸ ANPEP P15144 3/20 0.63
▸ CRHBP P24387 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ PDK2 Q15119 1/20 0.40
▸ MAPT P10636 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TYMS P04818 1/20 0.38
▸ IDH1 O75874 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ PLK1 P53350 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ AHR P35869 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
SCHEMBL11018003 0.91 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2PDK2
SCHEMBL11018629 0.90 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2PDK2
SCHEMBL11022233 0.90 DPP4 (0.63) DPP4ANPEPCRHBPCRHR2MAPT
SCHEMBL11019989 0.88 DPP4 (0.49) DPP4ANPEPCRHBPCRHR2PDK2
SCHEMBL11021201 0.86 DPP4 (0.59) DPP4ANPEPCRHBPCRHR2MAPT
SCHEMBL11017755 0.86 DPP4 (0.62) DPP4ANPEPCRHBPCRHR2MAPT
SCHEMBL11018541 0.86 ANPEP (0.55) DPP4ANPEPALDH1A1TP53L3MBTL1
SCHEMBL11022146 0.85 DPP4 (0.68) DPP4ANPEPCRHBPCRHR2MAPT
SCHEMBL11022176 0.84 DPP4 (0.63) DPP4ANPEPCRHBPCRHR2PDK2
SCHEMBL11018014 0.84 DPP4 (0.56) DPP4ANPEPCRHBPCRHR2ALDH1A1

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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