SCHEMBL28492673

SCHEMBL28492673

CC(C)(C)OC(=O)N1CCCCC1.COc1ccc(C(N)=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 3/20 0.56
▸ PARP10 Q53GL7 2/20 0.55
▸ CA1 P00915 1/20 0.55
▸ CA2 P00918 1/20 0.55
▸ PARP1 P09874 1/20 0.55
▸ PARP2 Q9UGN5 1/20 0.55
▸ PARP4 Q9UKK3 1/20 0.55
▸ HPGD P15428 4/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPT P10636 4/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ HTT P42858 2/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ STS P08842 1/20 0.49
▸ ABL1 P00519 1/20 0.49

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
SCHEMBL28981115 0.82 GPR119 (0.48) GPR119HPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL30808538 0.81 GPR119 (0.55) GPR119HPGDMAPTMEN1KMT2A
SCHEMBL28494646 0.81 MEN1 (0.67) GPR119CA1CA2HPGDALDH1A1
SCHEMBL5530954 0.78 CHEK2 (0.67) GPR119PARP10ALDH1A1
SCHEMBL13218466 0.77 GPR119 (0.79) GPR119ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL4240126 0.76 POLB (0.69) GPR119ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5233751 0.76 L3MBTL1 (0.66) GPR119ALDH1A1MAPTL3MBTL1SMN1; SMN2
SCHEMBL19852529 0.76 HPGD (0.71) HPGDALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL2077166 0.76 HPGD (0.71) HPGDALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL21707988 0.76 HPGD (0.71) HPGDALDH1A1MAPTSMN1; SMN2HTT

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-107226808-B Tankyrase inhibitors 北京四环制药有限公司 2021-01-01 — — CN disclosed
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