SCHEMBL11018446

SCHEMBL11018446

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)NCCCN(C)C)c2C1=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.52
▸ ANPEP P15144 3/20 0.52
▸ HPGD P15428 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.41
▸ TOP2A P11388 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ DRD2 P14416 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ POLR1A O95602 1/20 0.39

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
SCHEMBL11018631 0.92 DPP4 (0.56) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11022122 0.88 DPP4 (0.57) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11016780 0.88 DPP4 (0.54) DPP4ANPEPHPGDALDH1A1HTT
SCHEMBL11018040 0.88 DPP4 (0.54) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11019423 0.87 DPP4 (0.53) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11018535 0.86 DPP4 (0.57) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11018669 0.85 DPP4 (0.56) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11021879 0.85 DPP4 (0.61) DPP4ANPEPALDH1A1HTTNR1H2
SCHEMBL11021927 0.84 DPP4 (0.55) DPP4ANPEPHPGDALDH1A1HTT
SCHEMBL11019064 0.84 DPP4 (0.60) DPP4ANPEPALDH1A1HTTNR1H2

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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