SCHEMBL5532444

SCHEMBL5532444

CCOC(=O)CN(Cc1ccccc1)C(=O)C(CC(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 11/20 0.54
PSEN2 P49810 11/20 0.54
APH1B Q8WW43 11/20 0.54
NCSTN Q92542 11/20 0.54
APH1A Q96BI3 11/20 0.54
PSENEN Q9NZ42 11/20 0.54
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CTSS P25774 2/20 0.47
REN P00797 2/20 0.46
CTSK P43235 3/20 0.44

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
SCHEMBL4631066 1.00 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3492066 1.00 PSEN1 (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21284465 0.91 CTSS (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL26869285 0.91 CTSS (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23496889 0.89 CTSS (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17294368 0.89 CTSK (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7333998 0.89 CTSS (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7731324 0.89 CTSK (0.54) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15279944 0.89 CTSS (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18894022 0.89 CTSS (0.47) PSEN1PSEN2APH1BNCSTNAPH1A

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-20070032502-A1 Quinazoline derivatives useful in cancer treatment SCHERING CORPORATION 2007-02-08 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-20070032502-A1 Quinazoline derivatives useful in cancer treatment TP53, ACIN1, TP53BP1 PSEN1 3444/4885PSEN2 4303/4885APH1B 4465/4885

“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.