SCHEMBL21999614

SCHEMBL21999614

O=C(O)c1ccc(-c2ccccc2)cc1NS(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 16/20 0.61
▸ KCNA5 P22460 1/20 0.53
▸ MCL1 Q07820 2/20 0.52

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
SCHEMBL21999681 0.92 ACLY (0.61) ACLYMCL1
SCHEMBL2251898 0.81 ACLY (0.61) ACLYMCL1
SCHEMBL4226821 0.81 KDM4C (0.50) ACLY
SCHEMBL22000089 0.81 ACLY (0.72) ACLYMCL1
SCHEMBL17737439 0.81 MEN1 (0.54) KCNA5
SCHEMBL21999679 0.80 ACLY (0.71) ACLYMCL1
Trifluoroacetic Acid SCHEMBL4213728 0.76 ACLY (0.45) ACLY
SCHEMBL21999860 0.76 ACLY (0.69) ACLYMCL1
SCHEMBL21930839 0.76 ACLY (1.00) ACLY
SCHEMBL17737682 0.75 MEN1 (0.56) KCNA5

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-20200148634-A1 ACLY INHIBITORS AND USES THEREOF Nimbus Artemis, Inc. 2020-05-14 — — 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-20200148634-A1 ACLY INHIBITORS AND USES THEREOF ACLY, ATP5ME, ATP5MG ACLY 1/4885KCNA5 3931/4885MCL1 2618/4885

“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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