SCHEMBL29640353

SCHEMBL29640353

CC(C)OC(=O)[C@](CC(C)(C)C)(NC(=S)NC(=O)OCc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 6/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CCR1 P32246 2/20 0.38
PTPN7 P35236 2/20 0.38
HTT P42858 2/20 0.38
ALOX12 P18054 1/20 0.38
OPRD1 P41143 1/20 0.38
TACR1 P25103 1/20 0.38
PPARA Q07869 2/20 0.38
OPRM1 P35372 1/20 0.38
DUSP3 P51452 1/20 0.38
CTSK P43235 1/20 0.37
TP53 P04637 1/20 0.37
CTSS P25774 1/20 0.36

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
SCHEMBL22579540 0.91 AAK1 (0.40) OPRK1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL28407518 0.91 AAK1 (0.40) OPRK1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL21112426 0.88 PPARA (0.41) OPRK1MEN1KMT2ALMNAMAPT
SCHEMBL21112423 0.88 PPARA (0.41) OPRK1MEN1KMT2ALMNAMAPT
SCHEMBL28407522 0.87 CTSS (0.34) OPRK1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL20908059 0.87 CTSS (0.34) OPRK1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL28407464 0.85 TRPV1 (0.38) OPRK1SMN1; SMN2CTSSAAK1
SCHEMBL29640239 0.85 TRPV1 (0.38) OPRK1SMN1; SMN2CTSSAAK1
SCHEMBL20907784 0.84 KMT2A (0.39) OPRK1MEN1KMT2ASMN1; SMN2CTSK
SCHEMBL28403743 0.84 KMT2A (0.39) OPRK1MEN1KMT2ASMN1; SMN2CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352329-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2022-06-07 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-11352329-B2 HIV protease inhibitors PRSS1, SERPINB1, FURIN OPRK1 2622/4885MEN1 2814/4885KMT2A 1556/4885

“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.