SCHEMBL6943131

SCHEMBL6943131

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nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31

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
SCHEMBL6943141 0.92 HCAR2 (0.41) HCAR2
SCHEMBL6943135 0.92 HCAR2 (0.41) HCAR2
SCHEMBL5968960 0.75
SCHEMBL672637 0.73
SCHEMBL379418 0.71
SCHEMBL8172217 0.71
SCHEMBL27848322 0.68
SCHEMBL28003196 0.68
SCHEMBL27996212 0.62
Ammonia Solution, Strong SCHEMBL28134136 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030039580-A1 Stable preservative formulations comprising halopropynyl compounds and butoxydiglycol solvent LONZA INC. (US) 2003-02-27 US claimed
WO-2002067685-A1 STABLE PRESERVATIVE FORMULATIONS COMPRISING HALOPROPYNYL COMPOUNDS AND BUTOXYDIGLYCOL SOLVENT LONZA INC. (US) 2002-09-06 WO claimed
EP-1022950-B1 STABILISED MIXTURES OF AN IODOPROPARGYL COMPOUND AND A FORMALDEHYDE DONOR LONZA AG (US) 2003-08-20 EP disclosed
US-6582627-B1 Aqueous liquid, broad-spectrum, low free-formaldehyde synergistic preservative mixtures of an iodopropynyl compound and a formaldehyde donor LONZA INC. 2003-06-24 US disclosed
US-20030039580-A1 Stable preservative formulations comprising halopropynyl compounds and butoxydiglycol solvent LONZA INC. (US) 2003-02-27 US disclosed
WO-2002067685-A1 STABLE PRESERVATIVE FORMULATIONS COMPRISING HALOPROPYNYL COMPOUNDS AND BUTOXYDIGLYCOL SOLVENT LONZA INC. (US) 2002-09-06 WO disclosed
US-6143204-A STABILIZED IODOPROPYNYL SOLUTION CONSISTS OF AN IODOPROPYNYL COMPOUND AND A STABILIZER WHICH IS HYDANTOIN OR DERIVATIVE LONZA INC. (US) 2000-11-07 US disclosed
EP-1022950-A1 STABILISED MIXTURES OF AN IODOPROPARGYL COMPOUND AND A FORMALDEHYDE DONOR LONZA INC. (US) 2000-08-02 EP disclosed
WO-1999065316-A9 STABILIZED MIXTURES OF AN IODOPROPARGYL COMPOUND AND A FORMALDEHYDE DONOR LONZA AG (US) 2000-03-23 WO disclosed
WO-1999065316-A1 STABILIZED MIXTURES OF AN IODOPROPARGYL COMPOUND AND A FORMALDEHYDE DONOR LONZA INC. (US) 1999-12-23 WO 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-20030039580-A1 Stable preservative formulations comprising halopropynyl compounds and butoxydiglycol solvent DDC, HDHD5, GMDS KEAP1 569/4885NFE2L2 1943/4885HCAR2 2085/4885

“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.