SCHEMBL22000582

SCHEMBL22000582

Cc1c(Cl)cc(Cl)c(O)c1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 6/20 0.42
▸ HSD17B10 Q99714 6/20 0.37
▸ HPGD P15428 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ ALOX15 P16050 3/20 0.37
▸ GAA P10253 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ FABP3 P05413 1/20 0.37
▸ FABP4 P15090 1/20 0.37
▸ FABP5 Q01469 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ TSHR P16473 4/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ TTR P02766 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ RECQL P46063 2/20 0.34
▸ CASP1 P29466 1/20 0.34

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
SCHEMBL29433374 0.85 HSD17B10 (0.44) ACLYHSD17B10HPGDALDH1A1ALOX15
SCHEMBL21999657 0.84 ACLY (0.42) ACLYHSD17B10HPGDALDH1A1ALOX15
SCHEMBL25210351 0.74 CYP3A4 (0.35) ALDH1A1ALOX15GAAKMT2AFABP3
SCHEMBL5318762 0.73 CA1 (0.41) ACLYHSD17B10HPGDALDH1A1ALOX15
SCHEMBL9349986 0.72 CYP3A4 (0.37) HSD17B10HPGDALDH1A1ALOX15GAA
SCHEMBL10576669 0.72 CA1 (0.34) HSD17B10HPGDALOX15GAAFABP3
SCHEMBL28730405 0.72 AHR (0.36) HSD17B10HPGDALDH1A1ALOX15FABP3
SCHEMBL25828290 0.71 HSD17B10 (0.48) HSD17B10HPGDALDH1A1ALOX15GAA
SCHEMBL20025716 0.71 FABP3 (0.37) HSD17B10HPGDALDH1A1ALOX15FABP3
SCHEMBL20025727 0.71 FABP3 (0.37) HSD17B10HPGDALDH1A1ALOX15FABP3

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 1/4885HSD17B10 392/4885HPGD 1212/4885

“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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