SCHEMBL22005133

SCHEMBL22005133

O=S(=O)(Nc1ccc(Cl)cc1I)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACLY P53396 18/20 0.62
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
MCL1 Q07820 1/20 0.56
CCR2 P41597 1/20 0.54

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
SCHEMBL22021605 0.88 ACLY (0.66) ACLY
SCHEMBL22004211 0.86 ACLY (0.64) ACLY
SCHEMBL14433929 0.83 ACLY (0.72) ACLYHPGDTSHRMCL1CCR2
SCHEMBL22004216 0.80 ACLY (0.55) ACLYHPGDTSHRMCL1CCR2
SCHEMBL22004212 0.79 ACLY (0.67) ACLY
SCHEMBL22005135 0.79 HSP90AA1 (0.54) ACLYHPGDTSHRMCL1
SCHEMBL11650550 0.78 ACLY (0.67) ACLYMCL1CCR2
SCHEMBL22021608 0.77 ACLY (0.63) ACLYMCL1
SCHEMBL21999962 0.77 ACLY (1.00) ACLY
SCHEMBL11652003 0.75 ACLY (0.63) ACLYCCR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020102616-A1 ACLY INHIBITORS AND USES THEREOF Nimbus Artemis, Inc. (US) 2020-05-22 WO disclosed
US-20200157076-A1 ACLY INHIBITORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2020-05-21 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-20200157076-A1 ACLY INHIBITORS AND USES THEREOF ACLY, ATP5ME, ATP5MG ACLY 1/4885HPGD 1212/4885TSHR 4803/4885

“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.