SCHEMBL26830087

SCHEMBL26830087

O=C1C(C2CC2)[C@H](c2c(F)cc(-n3cc(C(F)(F)F)cn3)cc2F)N1c1ccc2[nH]cnc2c1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 19/20 0.40
▸ CTSK P43235 1/20 0.35
▸ CTSC P53634 1/20 0.35

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
SCHEMBL24814421 1.00 QPCT (0.40) QPCTCTSKCTSC
SCHEMBL30166814 1.00 QPCT (0.40) QPCTCTSKCTSC
SCHEMBL24814330 1.00 QPCT (0.40) QPCTCTSKCTSC
SCHEMBL25709729 0.94 QPCT (0.38) QPCTCTSKCTSC
SCHEMBL24816735 0.94 QPCT (0.37) QPCT
SCHEMBL26825952 0.89 QPCT (0.35) QPCT
SCHEMBL26824956 0.89 QPCT (0.35) QPCT
SCHEMBL24815542 0.87 QPCT (0.40) QPCT
SCHEMBL24814369 0.87 QPCT (0.40) QPCT
SCHEMBL24815541 0.87 QPCT (0.40) QPCT

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-11834440-B2 Beta-lactam derivatives for the treatment of diseases INSILICO MEDICINE IP LIMITED (HK) 2023-12-05 — — 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-11834440-B2 Beta-lactam derivatives for the treatment of diseases QPCT, QPCTL, BCAT1 QPCT 1/4885CTSK 2567/4885CTSC 655/4885

“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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