SCHEMBL11018487

SCHEMBL11018487

CCc1cccc(C(C)CC)c1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.50
▸ ANPEP P15144 2/20 0.48
▸ DPP4 P27487 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.46
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA2 P00918 3/20 0.44
▸ CA9 Q16790 3/20 0.44
▸ CA12 O43570 2/20 0.43
▸ CA1 P00915 2/20 0.43
▸ S100A4 P26447 2/20 0.39
▸ PTPRC P08575 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL9812682 0.87 ANPEP (0.62) LMNAANPEPDPP4KDM4ECYP1A2
SCHEMBL11019714 0.82 DPP4 (0.53) LMNAANPEPDPP4MAPTHTT
SCHEMBL11017675 0.82 DPP4 (0.53) ANPEPDPP4KDM4EMAPTPTPRC
SCHEMBL11022123 0.81 DPP4 (0.55) ANPEPDPP4
SCHEMBL9812676 0.81 DPP4 (0.63) LMNAANPEPDPP4KDM4ECYP1A2
SCHEMBL11021633 0.80 DPP4 (0.50) ANPEPDPP4
SCHEMBL11021544 0.79 DPP4 (0.52) LMNAANPEPDPP4MAPTL3MBTL1
SCHEMBL11018418 0.78 DPP4 (0.51) ANPEPDPP4
SCHEMBL11019989 0.76 DPP4 (0.49) ANPEPDPP4CYP1A2CYP2C9CYP2C19
SCHEMBL11016927 0.76 ANPEP (0.49) ANPEPDPP4KDM4EMAPTHTT

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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