SCHEMBL30201901

SCHEMBL30201901

COC(C)CON1C(=O)c2ccccc2C1=O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
GAA P10253 1/20 0.51
ALDH1A1 P00352 6/20 0.49
RECQL P46063 1/20 0.48
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 2/20 0.45
MAPT P10636 2/20 0.45
CYP2C9 P11712 1/20 0.45
HTT P42858 1/20 0.42
ATM Q13315 2/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL3576904 0.84 GAA (0.56) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL19961833 0.84 GAA (0.56) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL2296725 0.81 POLB (0.58) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL2296722 0.81 POLB (0.58) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL31208299 0.81 POLB (0.58) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL26316343 0.81 GAA (0.53) POLBSMN1; SMN2GAAALDH1A1RECQL
SCHEMBL19894030 0.80 POLB (0.48) POLBSMN1; SMN2GAAALDH1A1MEN1
SCHEMBL19894029 0.80 POLB (0.48) POLBSMN1; SMN2GAAALDH1A1MEN1
SCHEMBL28982868 0.80 POLB (0.48) POLBSMN1; SMN2GAAALDH1A1MEN1
SCHEMBL21501547 0.79 GAA (0.51) POLBSMN1; SMN2GAAALDH1A1RECQL

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-109422749-B Pyrimidinedione derivative for inhibiting monocarboxylic acid transporter 重庆医药工业研究院有限责任公司 2023-01-24 CN disclosed