SCHEMBL11017915

SCHEMBL11017915

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)OCCOc3ccccc3)c2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.52
▸ ANPEP P15144 4/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ NR1H2 P55055 1/20 0.43
▸ NR1H3 Q13133 1/20 0.43
▸ MMP1 P03956 1/20 0.41
▸ MMP12 P39900 1/20 0.41
▸ CYP2D6 P10635 1/20 0.38
▸ CYP19A1 P11511 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
SCHEMBL11017658 0.90 DPP4 (0.54) DPP4ANPEPSMN1; SMN2MEN1KMT2A
SCHEMBL11017174 0.87 DPP4 (0.56) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11021646 0.87 DPP4 (0.56) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11021398 0.86 DPP4 (0.57) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL11018520 0.86 DPP4 (0.57) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11017241 0.85 DPP4 (0.54) DPP4ANPEPSMN1; SMN2MEN1KMT2A
SCHEMBL11020289 0.85 DPP4 (0.56) DPP4ANPEPMEN1KMT2ANPC1
SCHEMBL11018523 0.85 DPP4 (0.58) DPP4ANPEPNPC1KDM4EHPGD
SCHEMBL11018885 0.84 DPP4 (0.53) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL11018146 0.84 DPP4 (0.55) DPP4ANPEPSMN1; SMN2ALDH1A1KDM4E

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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