SCHEMBL2560936

SCHEMBL2560936

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nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.72
ALOX15 P16050 1/20 0.72
HPGD P15428 1/20 0.50
PTPN1 P18031 1/20 0.50
FNTA P49354 2/20 0.43
FNTB P49356 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
PGGT1B P53609 1/20 0.43

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
SCHEMBL2560933 1.00 ALDH1A1 (0.72) ALDH1A1ALOX15HPGDPTPN1FNTA
SCHEMBL10613500 0.96 ALDH1A1 (0.73) ALDH1A1ALOX15HPGDPTPN1FNTA
SCHEMBL10613495 0.96 ALDH1A1 (0.73) ALDH1A1ALOX15HPGDPTPN1FNTA
Geranyl Acetate SCHEMBL901162 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL56913 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL1865830 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL236190 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL56914 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL1869319 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
SCHEMBL11785322 0.83 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118001879-A Application of nano copper alloy in filtering harmful substances in cigarette smoke 广东合一新材料研究院有限公司 2024-05-10 CN claimed
CN-118001879-A Application of nano copper alloy in filtering harmful substances in cigarette smoke 广东合一新材料研究院有限公司 2024-05-10 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
US-10188627-B2 PPAR agonists, compounds, pharmaceutical compositions, and methods of use thereof MITOBRIDGE, INC. (US) 2019-01-29 US disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20170304255-A1 PPAR AGONISTS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2017-10-26 US disclosed
WO-2016057660-A1 PPAR AGONISTS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF MITOBRIDGE, INC. (US) 2016-04-14 WO disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed
WO-2009104605-A1 NOVEL INTERMEDIATE FOR SYNTHESIS OF ASCOFRANONE HAVING VARIOUS PHYSIOLOGICAL ACTIVITIES, AND NOVEL SHORTENED TOTAL SYNTHESIS METHOD FOR ASCOFRANONE USING THE SAME アリジェン製薬株式会社 (JP) 2009-08-27 WO disclosed
EP-0269230-A1 Heterocyclic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1988-06-01 EP disclosed
US-4260551-A ALIPHATIC OR AROMATIC ESTERS, ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1981-04-07 US disclosed
US-4192953-A TREATMENT OF PEPTIC ULCERS SANKYO COMPANY LIMITED (JP) 1980-03-11 US disclosed
US-4059641-A ANTIULCER SANKYO COMPANY LIMITED (JA) 1977-11-22 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 (2 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-10188627-B2 PPAR agonists, compounds, pharmaceutical compositions, and methods of use thereof PPARG, PPARD, PPARA ALDH1A1 991/4885ALOX15 630/4885HPGD 356/4885
US-20170304255-A1 PPAR AGONISTS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF PPARG, PPARD, PPARA ALDH1A1 991/4885ALOX15 630/4885HPGD 356/4885

“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.