SCHEMBL11020213

SCHEMBL11020213

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)Nc3ccccn3)c2C1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.53
▸ ANPEP P15144 2/20 0.53
▸ CHRNB2 P17787 1/20 0.48
▸ CHRNB4 P30926 1/20 0.48
▸ CHRNA3 P32297 1/20 0.48
▸ CHRNA4 P43681 1/20 0.48
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ NR1H2 P55055 1/20 0.44
▸ NR1H3 Q13133 1/20 0.44
▸ POLB P06746 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL11016999 0.88 DPP4 (0.56) DPP4ANPEPNR1H2NR1H3POLB
SCHEMBL11018033 0.84 DPP4 (0.58) DPP4ANPEPCHRNB2CHRNB4CHRNA3
SCHEMBL11018100 0.83 DPP4 (0.55) DPP4ANPEPMEN1KMT2AL3MBTL1
SCHEMBL11018576 0.82 ANPEP (0.51) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11017926 0.81 DPP4 (0.64) DPP4ANPEPMEN1KMT2ANR1H2
SCHEMBL11021461 0.81 DPP4 (0.64) DPP4ANPEPMEN1KMT2ANR1H2
SCHEMBL11020919 0.81 DPP4 (0.65) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11018545 0.81 DPP4 (0.57) DPP4ANPEPMEN1KMT2ANR1H2
SCHEMBL11021588 0.80 DPP4 (0.52) DPP4ANPEPMEN1KMT2AKDM4E
SCHEMBL11017368 0.80 DPP4 (0.62) DPP4ANPEPKMT2ANR1H2NR1H3

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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