SCHEMBL11017362

SCHEMBL11017362

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C#N)c2C1=O

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.64
▸ ANPEP P15144 6/20 0.64
▸ NR1H2 P55055 1/20 0.52
▸ NR1H3 Q13133 1/20 0.52
▸ PGR P06401 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ HTR2C P28335 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ ADORA2A P29274 1/20 0.35

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
SCHEMBL11018434 0.92 DPP4 (0.55) DPP4ANPEPNR1H2NR1H3
SCHEMBL11021077 0.90 DPP4 (0.52) DPP4ANPEPNR1H2NR1H3PGR
SCHEMBL17531036 0.84 DPP4 (0.54) DPP4ANPEPNR1H2NR1H3FAAH
SCHEMBL17531032 0.83 DPP4 (0.53) DPP4ANPEPNR1H2NR1H3FAAH
SCHEMBL11018522 0.81 DPP4 (0.63) DPP4ANPEP
SCHEMBL11020337 0.81 DPP4 (0.61) DPP4ANPEPNR1H2NR1H3
SCHEMBL3284832 0.80 ANPEP (0.50) DPP4ANPEPNR1H2NR1H3
SCHEMBL11018078 0.80 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3HTR2B
SCHEMBL11016604 0.80 DPP4 (0.71) DPP4ANPEPNR1H2NR1H3
SCHEMBL17531023 0.80 ANPEP (0.52) DPP4ANPEPNR1H2NR1H3FAAH

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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