SCHEMBL29445191

SCHEMBL29445191

O=C1C[C@H](c2ccccc2)N1c1ccc2[nH]cnc2c1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 18/20 0.52
▸ ESR1 P03372 1/20 0.43
▸ ESR2 Q92731 1/20 0.43
▸ IP6K1 Q92551 1/20 0.41
▸ QPCTL Q9NXS2 1/20 0.41

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
SCHEMBL20853792 1.00 QPCT (0.52) QPCTESR1ESR2IP6K1QPCTL
SCHEMBL29445215 1.00 QPCT (0.52) QPCTESR1ESR2IP6K1QPCTL
SCHEMBL29445163 0.90 QPCT (0.64) QPCTQPCTL
SCHEMBL20853753 0.90 QPCT (0.64) QPCTQPCTL
SCHEMBL20853751 0.90 QPCT (0.64) QPCTQPCTL
SCHEMBL20853782 0.90 QPCT (0.64) QPCTQPCTL
SCHEMBL1444549 0.88 QPCT (0.50) QPCTIP6K1QPCTL
SCHEMBL31513758 0.84 ADRA1A (0.42) QPCTQPCTL
SCHEMBL1444543 0.84 QPCT (0.72) QPCTQPCTL
SCHEMBL12274345 0.81 QPCT (0.62) QPCTIP6K1QPCTL

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-11279690-B2 Inhibitors of glutaminyl cyclase VIVORIAN THERAPEUTICS N.V 2022-03-22 — — 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-11279690-B2 Inhibitors of glutaminyl cyclase QPCT, QPCTL, GLUL QPCT 1/4885ESR1 4403/4885ESR2 4299/4885

“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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