SCHEMBL28824022

SCHEMBL28824022

NS(=O)(=O)c1ccccc1-c1ccc(-n2nncc2C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.56
F2 P00734 4/20 0.56
PRSS1 P07477 2/20 0.56
PRSS2 P07478 2/20 0.56
PRSS3 P35030 2/20 0.56

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
SCHEMBL28824026 0.88 F10 (0.49) F10F2PRSS1PRSS2PRSS3
SCHEMBL28824005 0.82 ALDH1A1 (0.42) F10F2PRSS1PRSS2PRSS3
SCHEMBL28824096 0.82 ALOX5AP (0.51)
SCHEMBL6761528 0.81 F10 (0.74) F10
SCHEMBL28823984 0.81 BRS3 (0.43)
SCHEMBL28824097 0.80 BCAT2 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL28824030 0.80 DHODH (0.48)
SCHEMBL28824037 0.80 MCL1 (0.46)
SCHEMBL28824043 0.80 KMT2A (0.49)
SCHEMBL28824102 0.80 MAPK9 (0.46) F10F2PRSS1PRSS2PRSS3

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-114929676-A Heterocyclic carboxylate compounds as glycolate oxidase inhibitors 紫丁香疗法有限公司 2022-08-19 CN disclosed