SCHEMBL23218008

SCHEMBL23218008

CC(C)OCCn1c(SC(C)OC(=O)N(C(C)C)C(C)C)nc(=O)c2[nH]ccc21

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.46
▸ MPO P05164 1/20 0.46
▸ BCHE P06276 1/20 0.35
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSP90AA1 P07900 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
SCHEMBL23225646 0.80 OPRM1 (0.45) OPRM1MPOLMNAPOLBTSHR
SCHEMBL23225647 0.79 OPRM1 (0.46) OPRM1MPOBCHELMNAPOLB
SCHEMBL23225605 0.77 OPRM1 (0.44) OPRM1MPOBCHELMNAPOLB
SCHEMBL23217973 0.76 OPRM1 (0.43) OPRM1MPOLMNAPOLBTSHR
SCHEMBL23225723 0.75 OPRM1 (0.45) OPRM1MPOLMNAPOLBTSHR
SCHEMBL23217980 0.74 OPRM1 (0.33) OPRM1MPO
Verdiperstat SCHEMBL23225670 0.74 MPO (0.58) OPRM1MPO
SCHEMBL23217941 0.73 OPRM1 (0.40) OPRM1MPOLMNAPOLBTSHR
SCHEMBL23217928 0.72 OPRM1 (0.47) OPRM1MPOLMNATSHRHSP90AA1
SCHEMBL23217978 0.71 OPRM1 (0.33) OPRM1MPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — US disclosed
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — US disclosed
EP-4041735-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS Biohaven Therapeutics Ltd. (US) 2022-08-17 — — EP disclosed
WO-2021072140-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. (US) 2021-04-15 — — WO disclosed
WO-2021072140-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. (US) 2021-04-15 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS MPO, CAT, SOD1 OPRM1 1161/4885MPO 1/4885BCHE 27/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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