SCHEMBL23225712

SCHEMBL23225712

CC(C)OCCn1c(SCOC(=O)CNC(=O)OC(C)(C)C)nc(=O)c2c1ccn2COC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ PCSK9 Q8NBP7 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
SCHEMBL27102074 0.97 LMNA (0.33) POLBLMNARXFP1
SCHEMBL23225607 0.86 TSHR (0.32) POLBLMNATSHR
SCHEMBL23218002 0.81 LMNA (0.31) POLBLMNATSHR
SCHEMBL23225648 0.81 LMNA (0.32) POLBLMNATSHR
SCHEMBL23218000 0.80 LMNA (0.30) POLBLMNA
SCHEMBL27103572 0.79 OPRM1 (0.32) LMNATSHR
SCHEMBL27102078 0.78 MPO (0.45) LMNARXFP1TSHR
SCHEMBL27102076 0.76 KDM4E (0.31) —
SCHEMBL27102043 0.75 TSHR (0.33) POLBLMNATSHR
SCHEMBL23217954 0.74 MEN1 (0.31) —

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
US-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — US 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 POLB 284/4885LMNA 2736/4885RXFP1 4071/4885

“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.

Send feedback