SCHEMBL11021889

SCHEMBL11021889

C=CCNC(=O)c1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.55
▸ ANPEP P15144 4/20 0.55
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ CYP1A2 P05177 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ POLB P06746 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C19 P33261 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
SCHEMBL11021879 0.88 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019064 0.86 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018535 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11020754 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11022122 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018111 0.84 DPP4 (0.57) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11017368 0.84 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018669 0.83 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018631 0.83 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11019423 0.83 DPP4 (0.53) 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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