SCHEMBL11016971

SCHEMBL11016971

CNC(=O)c1cccc2c1C(=O)N(c1c(C(C)C)cc(C(C)C)cc1C(C)C)C2=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.52
▸ ANPEP P15144 5/20 0.52
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ PDK2 Q15119 1/20 0.36
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ TYMS P04818 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL11021461 0.90 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3PDK2
SCHEMBL11018124 0.87 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11017664 0.86 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3PDK2
SCHEMBL11018319 0.86 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11021557 0.86 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3CTDSP1
SCHEMBL11016792 0.84 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3ALDH1A1
SCHEMBL11018629 0.82 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3PDK2
SCHEMBL11017926 0.81 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019780 0.80 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11017368 0.80 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3POLB

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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