SCHEMBL19424659

SCHEMBL19424659

O=C(NS(=O)(=O)c1ccc(NCC2CCOCC2)c([N+](=O)O)c1)c1ccc(N2CCN(Cc3ccccc3-c3ccc(CN4[C@@H]5CCC[C@H]4CC5)s3)CC2)cc1Oc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 15/20 0.66

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
SCHEMBL2830865 0.96 BCL2 (0.72) BCL2
SCHEMBL2830872 0.96 BCL2 (0.72) BCL2
SCHEMBL1958378 0.96 BCL2 (0.72) BCL2
SCHEMBL19424669 0.89 BCL2 (0.55) BCL2
SCHEMBL19424670 0.89 BCL2 (0.55) BCL2
SCHEMBL2830032 0.86 BCL2 (0.64) BCL2
SCHEMBL2830019 0.86 BCL2 (0.64) BCL2
SCHEMBL1957857 0.86 BCL2 (0.64) BCL2
SCHEMBL2831214 0.85 BCL2 (0.56) BCL2
SCHEMBL2387374 0.85 BCL2 (0.59) BCL2

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-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES UNITY BIOTECHNOLOGY, INC. 2017-10-05 — — 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-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES TP53, NQO1, SHMT2 BCL2 520/4885

“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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