SCHEMBL28568963

SCHEMBL28568963

CC(C)(C)OC(=O)N1CCN(Cc2ccn(Cc3ccc(Cl)c(Cl)c3)c(=O)c2O)CC1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 5/20 0.82
▸ EGLN1 Q9GZT9 5/20 0.82
▸ KDM1A O60341 1/20 0.47
▸ IDO1 P14902 1/20 0.42
▸ TDO2 P48775 1/20 0.42
▸ IDO2 Q6ZQW0 1/20 0.42
▸ FAAH O00519 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ SETD7 Q8WTS6 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ DRD4 P21917 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
Izilendustat SCHEMBL1770480 0.90 VEGFA (1.00) VEGFAEGLN1KDM1AIDO1TDO2
SCHEMBL17005885 0.89 VEGFA (0.65) VEGFAEGLN1FAAHALDH1A1GAA
SCHEMBL28566294 0.89 VEGFA (0.85) VEGFAEGLN1IDO1TDO2IDO2
SCHEMBL17005859 0.89 VEGFA (0.64) VEGFAEGLN1FAAHALDH1A1GAA
SCHEMBL28570561 0.89 VEGFA (0.79) VEGFAEGLN1IDO1TDO2IDO2
SCHEMBL28562999 0.88 VEGFA (0.85) VEGFAEGLN1KDM1AIDO1TDO2
SCHEMBL1770452 0.88 EGLN1 (0.81) VEGFAEGLN1FAAHSMN1; SMN2
SCHEMBL1770282 0.87 VEGFA (0.83) VEGFAEGLN1KDM1AIDO1TDO2
SCHEMBL28563647 0.87 VEGFA (0.83) VEGFAEGLN1KDM1AIDO1TDO2
SCHEMBL28567361 0.87 VEGFA (0.83) VEGFAEGLN1IDO1TDO2IDO2

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
CN-106232120-B Process for preparing N-benzyl-3-hydroxy-4-substituted-pyridin-2- (1H) -ones 爱尔皮奥治疗有限公司 2021-01-08 — — CN disclosed
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