SCHEMBL11021459

SCHEMBL11021459

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)NCc3ccncc3)c2C1=O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.52
▸ ANPEP P15144 3/20 0.52
▸ MAPK1 P28482 1/20 0.47
▸ POLB P06746 2/20 0.45
▸ ELANE P08246 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CCR1 P32246 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL11018022 0.89 DPP4 (0.53) DPP4ANPEPPOLBKDM4ENR1H2
SCHEMBL11021879 0.85 DPP4 (0.61) DPP4ANPEPPOLBHTTNR1H2
SCHEMBL11019151 0.84 ANPEP (0.48) DPP4ANPEPSMN1; SMN2
SCHEMBL11018100 0.84 DPP4 (0.55) DPP4ANPEPMAPK1POLBHTT
SCHEMBL11019064 0.84 DPP4 (0.60) DPP4ANPEPPOLBHTTNR1H2
SCHEMBL11021461 0.82 DPP4 (0.64) DPP4ANPEPPOLBNR1H2NR1H3
SCHEMBL11018535 0.82 DPP4 (0.57) DPP4ANPEPMAPK1POLBKDM4E
SCHEMBL11018111 0.82 DPP4 (0.57) DPP4ANPEPPOLBHTTNR1H2
SCHEMBL11022122 0.82 DPP4 (0.57) DPP4ANPEPPOLBHTTNR1H2
SCHEMBL11020754 0.82 DPP4 (0.57) DPP4ANPEPPOLBHTTNR1H2

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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