SCHEMBL5892022

SCHEMBL5892022

O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)C(O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.46
▸ LMNA P02545 3/20 0.42
▸ CES2 O00748 1/20 0.42
▸ CES1 P23141 1/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ KCNA5 P22460 5/20 0.40
▸ GAA P10253 1/20 0.40
▸ PTGS1 P23219 5/20 0.39
▸ PTGS2 P35354 5/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL5928515 0.81 ALDH1A1 (0.62) LMNACES2CES1KMT2AALDH1A1
SCHEMBL2732048 0.81 KMT2A (0.60) CA2LMNAKMT2AALDH1A1MEN1
Hydrochloric Acid SCHEMBL810 0.79 KMT2A (0.58) CA2LMNAKMT2AALDH1A1MEN1
SCHEMBL3353838 0.76 CA2 (0.57) CA2KMT2AALDH1A1MEN1KDM4E
SCHEMBL594 0.76 CA2 (0.53) CA2KMT2AALDH1A1MEN1GAA
SCHEMBL5444394 0.76 CA2 (0.53) CA2LMNAKMT2AALDH1A1MEN1
SCHEMBL7326944 0.76 LMNA (0.53) LMNACES2CES1KMT2AALDH1A1
SCHEMBL5483965 0.76 LMNA (0.53) LMNACES2CES1KMT2AALDH1A1
SCHEMBL27575403 0.74 MEN1 (0.54) CA2LMNAKMT2AALDH1A1MEN1
SCHEMBL1395462 0.74 LMNA (0.52) LMNACES2CES1KMT2AALDH1A1

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-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 — — 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-20060135773-A1 Trisubstituted nitrogen modulators of tyrosine phosphatases PTPA, PTPN1, PTPRS CA2 2306/4885LMNA 4794/4885CES2 1479/4885

“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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