SCHEMBL31590982

SCHEMBL31590982

O=c1[nH]cc(Br)n2cncc12

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 2/20 0.34
BRD9 Q9H8M2 1/20 0.30
CHEK1 O14757 1/20 0.30
CHEK2 O96017 1/20 0.30
CDK1 P06493 1/20 0.30
GSK3B P49841 1/20 0.30
PRKDC P78527 1/20 0.30

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
SCHEMBL25344154 0.64 CDK5 (0.31)
SCHEMBL31353069 0.64 TP53 (0.60) GABRA5CHEK1CHEK2CDK1GSK3B
SCHEMBL31353079 0.62 GRIN2D (0.36) GABRA5
SCHEMBL31026839 0.62 TP53 (0.35) GABRA5CHEK1CHEK2CDK1GSK3B
SCHEMBL7983698 0.62 TP53 (0.35) GABRA5CHEK1CHEK2CDK1GSK3B
SCHEMBL4763948 0.61 PARP1 (0.59) GABRA5CHEK1CHEK2CDK1GSK3B
SCHEMBL22303712 0.59 PDE4B (0.36)
SCHEMBL20068354 0.58 LCK (0.33) GABRA5
SCHEMBL31214203 0.58 LCK (0.39) GABRA5BRD9
SCHEMBL4038341 0.57 PDE9A (0.39) GABRA5CHEK1CHEK2CDK1GSK3B

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-120051457-A Oxalic acid amide compound, pharmaceutical composition containing oxalic acid amide compound, preparation method and application of oxalic acid amide compound 四川科伦博泰生物医药股份有限公司 2025-05-27 CN disclosed