SCHEMBL30749327

SCHEMBL30749327

CN1CCN(C(=O)OCc2ccccc2)C(c2ccccc2Cn2c(=S)[nH]c(=O)c3[nH]ccc32)C1.CN1CCNC(c2ccccc2Cn2c(=S)[nH]c(=O)c3[nH]ccc32)C1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 15/20 0.53
▸ TPO P07202 9/20 0.43
▸ SIGMAR1 Q99720 5/20 0.38
▸ TMEM97 Q5BJF2 4/20 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
SCHEMBL27223472 0.94 MPO (0.49) MPOTPOSIGMAR1TMEM97
SCHEMBL30749340 0.94 MPO (0.49) MPOTPOSIGMAR1TMEM97
SCHEMBL30749194 0.85 MPO (0.72) MPOTPO
SCHEMBL27224116 0.85 MPO (0.72) MPOTPO
SCHEMBL27223964 0.83 MPO (0.46) MPOTPO
SCHEMBL30749367 0.83 MPO (0.46) MPOTPO
SCHEMBL30749324 0.81 MPO (0.71) MPOTPO
SCHEMBL30749360 0.80 MPO (0.59) MPOTPO
SCHEMBL27223531 0.80 MPO (0.59) MPOTPO
Trifluoroacetic Acid SCHEMBL30749336 0.79 MPO (0.51) MPOTPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573096-A1 INHIBITORS OF MYELOPEROXIDASE Astrazeneca AB (SE) 2025-06-25 — — EP disclosed
WO-2024038131-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-02-22 — — WO disclosed
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