SCHEMBL28563633

SCHEMBL28563633

Cc1cccc(C)c1Cn1ccc(CN2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 4/20 0.71
▸ EGLN1 Q9GZT9 4/20 0.71
▸ CHRM2 P08172 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ TERT O14746 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ DTYMK P23919 2/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ TDO2 P48775 1/20 0.39
▸ IDO2 Q6ZQW0 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HTT P42858 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ NSD2 O96028 1/20 0.37

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
SCHEMBL28573781 0.90 VEGFA (0.68) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL28586368 0.90 VEGFA (0.71) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL28563005 0.89 VEGFA (0.69) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL28567992 0.89 VEGFA (0.69) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL28571945 0.89 VEGFA (0.69) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL28563641 0.89 VEGFA (0.75) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL17005880 0.89 VEGFA (0.55) VEGFAEGLN1MGLLALDH1A1KDM4E
SCHEMBL17005950 0.89 VEGFA (0.55) VEGFAEGLN1ALDH1A1KDM4EPOLB
SCHEMBL28914255 0.88 VEGFA (0.68) VEGFAEGLN1CHRM2CHRM4CHRM1
SCHEMBL17309749 0.86 VEGFA (0.83) VEGFAEGLN1CHRM2CHRM4CHRM1

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
Send feedback