SCHEMBL21999730

SCHEMBL21999730

O=C(O)c1ccc(-c2ccccc2)cc1NS(=O)(=O)CCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACLY P53396 12/20 1.00
MCL1 Q07820 1/20 0.58
BCL2A1 Q16548 1/20 0.58

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
SCHEMBL2275253 0.86 ACLY (1.00) ACLYMCL1
SCHEMBL10054968 0.83 ACLY (0.71) ACLYMCL1BCL2A1
SCHEMBL2258538 0.82 ACLY (0.69) ACLY
SCHEMBL10024293 0.81 ACLY (0.68) ACLY
SCHEMBL21999685 0.81 ACLY (0.91) ACLY
SCHEMBL22000006 0.80 ACLY (0.67) ACLY
SCHEMBL21999580 0.80 ACLY (1.00) ACLY
SCHEMBL21999587 0.79 ACLY (1.00) ACLY
SCHEMBL21999891 0.79 ACLY (1.00) ACLYMCL1
SCHEMBL22000088 0.79 ACLY (0.64) ACLY

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 1/4885MCL1 2618/4885BCL2A1 4498/4885

“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.