SCHEMBL25437142

SCHEMBL25437142

CCN(CC(C)(C)C(=O)OC)c1nc2c(-c3ccc(C(=N)N)cc3F)cc(C(=O)O)cc2s1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 20/20 0.64
PRSS1 P07477 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
SCHEMBL25410236 0.89 TMPRSS15 (0.62) TMPRSS15
SCHEMBL25438679 0.85 TMPRSS15 (0.63) TMPRSS15
SCHEMBL25436043 0.79 TMPRSS15 (0.62) TMPRSS15
SCHEMBL25409275 0.78 TMPRSS15 (0.61) TMPRSS15
SCHEMBL25436865 0.78 TMPRSS15 (0.62) TMPRSS15
SCHEMBL22974871 0.78 TMPRSS15 (1.00) TMPRSS15
SCHEMBL25408803 0.75 TMPRSS15 (0.69) TMPRSS15
SCHEMBL25408392 0.73 TMPRSS15 (0.61) TMPRSS15
SCHEMBL25435411 0.73 TMPRSS15 (0.64) TMPRSS15PRSS1
SCHEMBL22974822 0.73 TMPRSS15 (1.00) TMPRSS15

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
EP-3778577-B1 NOVEL COMPOUND EXHIBITING ENTEROPEPTIDASE INHIBITORY ACTIVITY LG CHEMICAL LTD (KR) 2023-08-30 EP claimed