SCHEMBL25495648

SCHEMBL25495648

C=CCCCN(Cc1ccc(CCNC(=O)[C@]2(C)CCCN2C(=O)OC(C)(C)C)cc1)C(=O)CCC(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.33
▸ HRH3 Q9Y5N1 2/20 0.31
▸ TLR7 Q9NYK1 2/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 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
SCHEMBL25499826 0.83 CHRM5 (0.34) —
SCHEMBL23080720 0.82 CA2 (0.43) USP2TLR7
SCHEMBL25499824 0.80 HRH3 (0.35) HRH3
SCHEMBL23080795 0.79 FOLH1 (0.30) —
SCHEMBL25499825 0.78 TLR7 (0.33) HRH3TLR7OPRM1OPRD1
SCHEMBL23051801 0.77 CACNA1B (0.33) —
SCHEMBL23565704 0.77 HTRA1 (0.33) —
SCHEMBL23538085 0.76 CA2 (0.40) USP2
SCHEMBL25499823 0.74 HRH3 (0.40) HRH3
SCHEMBL25444900 0.74 FOLH1 (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-20230159592-A1 PCSK9 ANTAGONIST COMPOUNDS MERCK SHARP & DOHME LLC 2023-05-25 — — US disclosed
US-20230159592-A1 PCSK9 ANTAGONIST COMPOUNDS MERCK SHARP & DOHME LLC 2023-05-25 — — US 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-20230159592-A1 PCSK9 ANTAGONIST COMPOUNDS PCSK9, PCSK7, PCSK6 USP2 3955/4885HRH3 860/4885TLR7 213/4885

“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