SCHEMBL21999792

SCHEMBL21999792

O=C(O)c1ccc(-c2ccccc2)cc1NS(=O)(=O)c1c(Cl)nc2sccn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACLY P53396 19/20 1.00
CCKBR P32239 1/20 0.57

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
SCHEMBL22000077 0.84 ACLY (0.75) ACLY
SCHEMBL22000049 0.78 ACLY (1.00) ACLY
SCHEMBL17599323 0.78 ACLY (0.63) ACLYCCKBR
SCHEMBL1422633 0.74 ACLY (0.58) ACLYCCKBR
SCHEMBL9930450 0.73 ACLY (0.57) ACLYCCKBR
SCHEMBL21999605 0.72 ACLY (0.70) ACLY
SCHEMBL14042227 0.72 CCKBR (1.00) ACLYCCKBR
SCHEMBL1423219 0.72 ACLY (0.56) ACLYCCKBR
SCHEMBL1421966 0.71 ACLY (0.56) ACLYCCKBR
SCHEMBL14290796 0.71 ACLY (0.56) ACLYCCKBR

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 1/4885CCKBR 4249/4885

“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.