SCHEMBL30631900

SCHEMBL30631900

O=C(O)c1[nH]nnc1Nc1cc(Cl)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 1/20 0.43
CYP2C9 P11712 1/20 0.43
C1R P00736 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
POLB P06746 1/20 0.42
HAO1 Q9UJM8 5/20 0.40
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
ALPL P05186 1/20 0.39
GRIK1 P39086 1/20 0.38
GAA P10253 2/20 0.38
EGFR P00533 1/20 0.38
ALK Q9UM73 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 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
SCHEMBL22816862 1.00 CXCL8 (0.43) CXCL8CYP2C9C1RHDAC3HDAC1
Trifluoroacetic Acid SCHEMBL29514703 0.93 ALDH1A1 (0.40) CXCL8CYP2C9C1RHDAC3HDAC1
Trifluoroacetic Acid SCHEMBL22608513 0.93 ALDH1A1 (0.40) CXCL8CYP2C9C1RHDAC3HDAC1
SCHEMBL11334107 0.80 MEN1 (0.49) HDAC3HDAC1HDAC2HDAC6MEN1
SCHEMBL22608515 0.80 MAPT (0.38) CXCL8CYP2C9HDAC3HDAC1HDAC2
SCHEMBL22608548 0.79 KMO (0.47) HDAC3HDAC1HDAC2HDAC6MEN1
SCHEMBL30631902 0.78 HAO1 (0.41) MEN1KMT2APOLBHAO1ALPL
SCHEMBL22816548 0.78 HAO1 (0.41) MEN1KMT2APOLBHAO1ALPL
SCHEMBL22608748 0.78 HAO1 (0.38) C1RMEN1KMT2AHAO1ALDH1A1
SCHEMBL29490663 0.78 HAO1 (0.38) C1RMEN1KMT2AHAO1ALDH1A1

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-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-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-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