SCHEMBL11019714

SCHEMBL11019714

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

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.53
▸ ANPEP P15144 6/20 0.53
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ NR1H2 P55055 1/20 0.36
▸ NR1H3 Q13133 1/20 0.36
▸ ELANE P08246 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11016802 0.90 DPP4 (0.58) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11022123 0.89 DPP4 (0.55) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11017675 0.88 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11021633 0.87 DPP4 (0.50) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11021601 0.87 DPP4 (0.68) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11021544 0.83 DPP4 (0.52) DPP4ANPEPCRHBPCRHR2LMNA
SCHEMBL11016750 0.83 DPP4 (0.66) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11018487 0.82 LMNA (0.50) DPP4ANPEPLMNAMAPTHTT
SCHEMBL11018418 0.82 DPP4 (0.51) DPP4ANPEPCRHBPCRHR2NR1H2
SCHEMBL11016927 0.81 ANPEP (0.49) DPP4ANPEPCRHBPCRHR2ELANE

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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