SCHEMBL13061977

SCHEMBL13061977

CC(C)(C)OC(=O)c1cccc(CB2OC3C[C@@H]4C[C@@H](C4(C)C)[C@]3(C)O2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 8/20 0.46
▸ F2 P00734 8/20 0.43
▸ PRSS1 P07477 6/20 0.43
▸ PREP P48147 2/20 0.42
▸ PSEN1 P49768 1/20 0.41
▸ PSEN2 P49810 1/20 0.41
▸ APH1B Q8WW43 1/20 0.41
▸ NCSTN Q92542 1/20 0.41
▸ APH1A Q96BI3 1/20 0.41
▸ PSENEN Q9NZ42 1/20 0.41
▸ F10 P00742 1/20 0.40
▸ F7 P08709 1/20 0.40
▸ SLC7A5 Q01650 1/20 0.40

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
SCHEMBL3658623 1.00 PSMB5 (0.46) PSMB5F2PRSS1PREPPSEN1
SCHEMBL21356873 0.86 PREP (0.48) PSMB5F2PRSS1PREPPSEN1
SCHEMBL21365255 0.84 PSMB5 (0.55) PSMB5F2PRSS1PSEN1PSEN2
SCHEMBL21365291 0.83 PSMB5 (0.52) PSMB5F2PRSS1PSEN1PSEN2
SCHEMBL23656992 0.83 PSMB5 (0.52) PSMB5F2PRSS1PSEN1PSEN2
SCHEMBL13061975 0.82 PREP (0.44) PSMB5F2PRSS1PREPPSEN1
SCHEMBL3776158 0.82 PREP (0.44) PSMB5F2PRSS1PREPPSEN1
SCHEMBL30321063 0.82 PREP (0.44) PSMB5F2PRSS1PREPPSEN1
SCHEMBL16284883 0.81 EGFR (0.42) PSMB5F2PRSS1PREPPSEN1
SCHEMBL22370670 0.81 EGFR (0.42) PSMB5F2PRSS1PREPPSEN1

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-20100317621-A1 BETA-LACTAMASE INHIBITORS PROTEZ PHARMACEUTICALS, INC. 2010-12-16 — — 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-20100317621-A1 BETA-LACTAMASE INHIBITORS GANAB, BPGM, BLVRB PSMB5 1165/4885F2 2849/4885PRSS1 1459/4885

“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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