SCHEMBL4342124

SCHEMBL4342124

CC1(C)C2CC3OB([C@@H](N)Cc4ccccc4F)OC3(C)C1C2

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 9/20 0.45
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
F2 P00734 8/20 0.44
PREP P48147 2/20 0.43
PRSS1 P07477 2/20 0.43

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
Hydrochloric Acid SCHEMBL21529797 0.86 PSMB5 (0.42) PSMB5PSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL21530027 0.86 PSMB5 (0.54) PSMB5PSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL21530022 0.86 PSMB5 (0.54) PSMB5PSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL21529801 0.86 PSMB5 (0.42) PSMB5PSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL21529932 0.85 F2 (0.46) PSMB5PSEN1PSEN2APH1BNCSTN
Hydrochloric Acid SCHEMBL21529928 0.85 F2 (0.46) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL20628029 0.85 PSMB5 (0.56) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL22387966 0.85 PSMB5 (0.56) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL21529960 0.85 PSMB5 (0.56) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL21529957 0.85 PSMB5 (0.56) PSMB5PSEN1PSEN2APH1BNCSTN

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
EP-2212334-B1 PROTEASOME INHIBITORS MILLENNIUM PHARM INC (US) 2012-08-15 EP disclosed
US-20090099132-A1 Proteasome inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-16 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-20090099132-A1 Proteasome inhibitors PSMB5, PSMG3, PSMB1 PSMB5 1/4885PSEN1 143/4885PSEN2 284/4885

“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.