SCHEMBL123580

SCHEMBL123580

OCC1(COCC2CO2)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL1357524 0.89 TSHR (0.42) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL2571589 0.89 TSHR (0.45) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL37089 0.89 TSHR (0.45) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL3273407 0.89 TSHR (0.45) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL17435085 0.87 TSHR (0.44) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL1072587 0.85 TSHR (0.40) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
Bicarbonate SCHEMBL17603240 0.84 TSHR (0.39) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL17599129 0.83 TP53 (0.36) TSHRMAPK1ALDH1A1TP53CYP3A4
SCHEMBL5605882 0.80 TSHR (0.39) TSHRMAPK1ALDH1A1SMN1; SMN2TDP1
SCHEMBL19521466 0.78 USP2 (0.32) TSHRALDH1A1SMN1; SMN2

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 222 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402500-A Thermosetting composite modified asphalt suitable for emergency repair 朱吉鹏 2024-01-16 CN claimed
CN-112408861-B Environment-friendly normal-temperature thermosetting modified adhesive material for quick repair 南京励米青新材料科技有限公司 2022-12-13 CN claimed
CN-114085591-B High-adhesion mildew-resistant coating for cables 湖南华菱线缆股份有限公司 2022-05-27 CN claimed
CN-114085591-A High-adhesion mildew-resistant coating for cables 湖南华菱线缆股份有限公司 2022-02-25 CN claimed
CN-112408861-A Environment-friendly normal-temperature thermosetting modified adhesive material for quick repair 南京励米青新材料科技有限公司 2021-02-26 CN claimed
CN-110982289-A Normal-temperature thermosetting modified asphalt material 南京励米青新材料科技有限公司 2020-04-10 CN claimed
CN-104693072-B Multifunctional urethane acrylate as well as preparation method and application thereof 长兴(广州)光电材料有限公司 2017-01-18 CN claimed
CN-104513678-B Alkoxy quaternary ammonium salt and comprise their fuel 雅富顿化学公司 2016-11-30 CN claimed
CN-104693072-A Multifunctional urethane acrylate as well as preparation method and application thereof ETERNAL OPTOELECTRONIC MATERIALS GUANGZHOU CO LTD 2015-06-10 CN claimed
EP-2862916-A1 Alkoxylated quaternary ammonium salts and fuels containing them Afton Chemical Corporation (US) 2015-04-22 EP claimed
US-20150096516-A1 ALKOXYLATED QUATERNARY AMMONIUM SALTS AND FUELS CONTAINING THEM AFTON CHEMICAL CORPORATION (US) 2015-04-09 US claimed
US-8992636-B1 Alkoxylated quaternary ammonium salts and fuels containing them AFTON CHEMICAL CORPORATION (US) 2015-03-31 US claimed
CN-102911338-B Multifunctional urethane acrylate oligomer as well as synthesis method and application thereof ELERNAL GUANGZHOU PHOTOELECTRIC MATERIALS CO LTD 2014-07-30 CN claimed
CN-102633984-A Polyurethane-acrylate oligomer, and synthesis method and application thereof ETERNAL GUANGZHOU ELECTRONIC MATERIAL CO LTD 2012-08-15 CN claimed
CN-101747855-A Low-resistivity single-component conductive silver paste and preparation method thereof BEIJING HYSTIC NEW MATERIALS C 2010-06-23 CN claimed
WO-2024113146-A1 MOISTURE AND HEAT-CURABLE SEALING COMPOSITION SIKA TECHNOLOGY AG (CH) 2024-06-06 WO disclosed
EP-4339238-A1 THERMALLY EXPANDABLE COMPOSITION HAVING REDUCED ODOR IN EXPANDED STATE Sika Technology AG (CH) 2024-03-20 EP disclosed
WO-2003044089-A1 THERMOSETTING RESIN COMPOSITIONS USEFUL AS UNDERFILL SEALANTS HENKEL CORPORATION (US) 2003-05-30 WO disclosed
US-5130369-A Polymerization of a monomer with a chain transfer agent and a second monomer with the monomers interacting ROHM AND HAAS COMPANY (US) 1992-07-14 US disclosed
EP-0324569-A2 Process for preparing functionalized polymeric compositions ROHM AND HAAS COMPANY (US) 1989-07-19 EP 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-20150096516-A1 ALKOXYLATED QUATERNARY AMMONIUM SALTS AND FUELS CONTAINING THEM ALKBH3, AGT, ALK TSHR 4251/4885MAPK1 2802/4885ALDH1A1 308/4885

“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.