SCHEMBL30749360

SCHEMBL30749360

O=C(OCc1ccccc1)N1CCC(F)(F)CC1c1ccccc1Cn1c(=S)[nH]c(=O)c2[nH]ccc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 20/20 0.59
▸ TPO P07202 16/20 0.47
▸ CYP3A4 P08684 2/20 0.37
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL27223531 1.00 MPO (0.59) MPOTPOCYP3A4KCNH2
SCHEMBL30749324 0.94 MPO (0.71) MPOTPOCYP3A4KCNH2
SCHEMBL27223452 0.87 MPO (0.47) MPOTPOCYP3A4KCNH2
SCHEMBL30749255 0.87 MPO (0.47) MPOTPOCYP3A4KCNH2
SCHEMBL30749340 0.85 MPO (0.49) MPOTPO
SCHEMBL27223472 0.85 MPO (0.49) MPOTPO
Trifluoroacetic Acid SCHEMBL30749336 0.83 MPO (0.51) MPOTPOCYP3A4
Trifluoroacetic Acid SCHEMBL27223478 0.83 MPO (0.51) MPOTPOCYP3A4
SCHEMBL30749367 0.82 MPO (0.46) MPOTPO
SCHEMBL27223964 0.82 MPO (0.46) 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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