SCHEMBL11019780

SCHEMBL11019780

CC(C)NC(=O)c1cccc2c1C(=O)N(c1c(C(C)C)cccc1C(C)C)C2=O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 6/20 0.62
▸ ANPEP P15144 5/20 0.62
▸ NR1H2 P55055 1/20 0.48
▸ NR1H3 Q13133 1/20 0.48
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ AHR P35869 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ TYMS P04818 1/20 0.37

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
SCHEMBL11017325 0.93 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3TYMS
SCHEMBL11021461 0.89 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11017926 0.89 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11021547 0.88 DPP4 (0.63) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11017368 0.88 DPP4 (0.62) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11021879 0.86 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3KMT2A
SCHEMBL11020066 0.86 DPP4 (0.64) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11020739 0.86 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11016329 0.85 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3MEN1
SCHEMBL11019064 0.85 DPP4 (0.60) DPP4ANPEPNR1H2NR1H3MEN1

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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