SCHEMBL30631925

SCHEMBL30631925

O=C(O)c1[nH]nnc1COc1ccc(-c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMO O15229 4/20 0.43
HAO1 Q9UJM8 4/20 0.43
XDH P47989 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
MCL1 Q07820 2/20 0.39
BCL2L1 Q07817 1/20 0.39
ALKBH1 Q13686 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NR1H4 Q96RI1 3/20 0.38
LIFR P42702 1/20 0.38
DHODH Q02127 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
SCHEMBL22816014 1.00 KMO (0.43) KMOHAO1XDHMRGPRX4MCL1
Trifluoroacetic Acid SCHEMBL22608719 0.94 HAO1 (0.39) KMOHAO1XDHMRGPRX4MCL1
SCHEMBL30631919 0.90 MRGPRX4 (0.49) KMOHAO1MRGPRX4ALKBH1MAPT
SCHEMBL22816228 0.90 MRGPRX4 (0.49) KMOHAO1MRGPRX4ALKBH1MAPT
SCHEMBL22608317 0.87 HAO1 (0.44) HAO1MRGPRX4MCL1BCL2L1DHODH
SCHEMBL22807359 0.85 KMO (0.47) KMOHAO1MRGPRX4NR1H4
Trifluoroacetic Acid SCHEMBL29514724 0.84 MRGPRX4 (0.44) KMOHAO1MRGPRX4MAPT
Trifluoroacetic Acid SCHEMBL22608624 0.84 MRGPRX4 (0.44) KMOHAO1MRGPRX4MAPT
SCHEMBL22608720 0.83 CHUK (0.36) KMOHAO1MCL1BCL2L1ALKBH1
SCHEMBL22608436 0.80 PTGER4 (0.48) HAO1MRGPRX4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117126151-A Glycolate oxidase inhibitors for use in the treatment of disease 生物马林药物股份有限公司 2023-11-28 CN disclosed
CN-117069713-A Glycolate oxidase inhibitors for use in the treatment of disease 生物马林药物股份有限公司 2023-11-17 CN disclosed
CN-117069712-A Glycolate oxidase inhibitors for use in the treatment of disease 生物马林药物股份有限公司 2023-11-17 CN disclosed
CN-117024420-A Glycolate oxidase inhibitors for use in the treatment of disease 生物马林药物股份有限公司 2023-11-10 CN disclosed