SCHEMBL21999900

SCHEMBL21999900

CS(=O)(=O)NC(=O)c1ccc(F)c(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 15/20 0.70
▸ CPT2 P23786 1/20 0.52
▸ CPT1A P50416 1/20 0.52
▸ CPT1B Q92523 1/20 0.52
▸ SCN9A Q15858 1/20 0.44
▸ FLT1 P17948 1/20 0.44
▸ FLT4 P35916 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ HSD11B1 P28845 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42

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
SCHEMBL21931134 0.82 ACLY (1.00) ACLY
SCHEMBL7150197 0.72 ALDH1A1 (0.59) ACLYCPT2CPT1ACPT1BLMNA
SCHEMBL21999830 0.71 HDAC1 (0.50) ACLYSCN9A
SCHEMBL18013245 0.71 ACLY (0.49) ACLYSCN9A
SCHEMBL21930841 0.71 ACLY (1.00) ACLY
SCHEMBL3727556 0.70 ACLY (0.57) ACLYCPT2CPT1ACPT1BLMNA
SCHEMBL7990845 0.70 FLT1 (0.65) SCN9AFLT1FLT4KDRLMNA
SCHEMBL2489186 0.69 SMN1; SMN2 (0.53) ACLYMAPT
SCHEMBL3724899 0.69 FABP4 (0.59) ACLY
SCHEMBL24102246 0.69 KMT2A (0.61) ACLYLMNAMAPTHTT

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 1/4885CPT2 171/4885CPT1A 153/4885

“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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