SCHEMBL4168577

SCHEMBL4168577

O=C(S)CCC(=O)OC(=O)CCC(=O)S

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.38
PRSS1 P07477 1/20 0.30
CTSG P08311 1/20 0.30
CTRB1 P17538 1/20 0.30
CMA1 P23946 1/20 0.30

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
SCHEMBL3071953 0.79
SCHEMBL7752220 0.77
SCHEMBL10630073 0.75 TSHR (0.48) ALDH1A1TSHRPRSS1CTSGCTRB1
SCHEMBL11168981 0.73 GAA (0.52) ALDH1A1TSHR
SCHEMBL5499378 0.71 ALDH1A1 (0.50) ALDH1A1TSHRPRSS1CTSGCTRB1
SCHEMBL7712869 0.71 ALDH1A1 (0.50) ALDH1A1TSHRPRSS1CTSGCTRB1
SCHEMBL21518705 0.71 ALDH1A1 (0.67) ALDH1A1TSHR
SCHEMBL288701 0.71 LMNA (0.60) ALDH1A1TSHR
SCHEMBL1992862 0.71 LMNA (0.60) ALDH1A1TSHR
SCHEMBL22838532 0.71 TSHR (0.31) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115810753-B Composition for preparing negative electrode protective film, negative electrode protective film and preparation method thereof, lithium battery negative electrode and lithium battery 比亚迪股份有限公司 2025-03-21 CN claimed
CN-118398897-A Electrolyte and application thereof 江苏正力新能电池技术有限公司 2024-07-26 CN claimed
CN-117050291-A Carbon dioxide-based polythioester-polycarbonate block polymer and preparation method thereof 广东工业大学 2023-11-14 CN claimed
CN-115810753-A Composition for preparing negative electrode protective film, negative electrode protective film and preparation method thereof, lithium battery negative electrode and lithium battery 比亚迪股份有限公司 2023-03-17 CN claimed
CN-115810753-B Composition for preparing negative electrode protective film, negative electrode protective film and preparation method thereof, lithium battery negative electrode and lithium battery 比亚迪股份有限公司 2025-03-21 CN disclosed
CN-118398897-A Electrolyte and application thereof 江苏正力新能电池技术有限公司 2024-07-26 CN disclosed
CN-118398897-A Electrolyte and application thereof 江苏正力新能电池技术有限公司 2024-07-26 CN disclosed
CN-117050291-A Carbon dioxide-based polythioester-polycarbonate block polymer and preparation method thereof 广东工业大学 2023-11-14 CN disclosed
CN-115810753-A Composition for preparing negative electrode protective film, negative electrode protective film and preparation method thereof, lithium battery negative electrode and lithium battery 比亚迪股份有限公司 2023-03-17 CN disclosed
CN-115417995-A Polythioester and stereocomplex-based thermoplastic elastomer thereof 大连理工大学 2022-12-02 CN disclosed
EP-1391476-B1 PHOTOREACTIVE COMPOSITION SEKISUI CHEMICAL CO LTD (JP) 2015-12-09 EP disclosed
US-20090163697-A1 Multicomponent coupling and glycopeptide synthesis with cyclic thioanhydrides THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2009-06-25 US disclosed
US-7312013-B2 Photoreactive composition SEKISUI CHEMICAL CO., LTD. (JP) 2007-12-25 US disclosed
US-20040202956-A1 a photocurable mixture of a hydrolyzable metal (silyl) compound and a reaction, polymerization or crosslinking promoter; curing; adhesives, seals, semiconductors, dielectrics, microlenses, optical fibers, color filters, gas permeable films SEKISUI CHEMICAL CO., LTD. (JP) 2004-10-14 US disclosed
EP-1391476-A1 PHOTOREACTIVE COMPOSITION SEKISUI CHEMICAL CO., LTD. (JP) 2004-02-25 EP disclosed
JP-2001048881-A NEW SELENIUM-CONTAINING COMPOUND FUJI PHOTO FILM CO LTD 2001-02-20 JP disclosed
US-5399710-A Protein labeling reagents NEORX CORPORATION (US) 1995-03-21 US disclosed
US-5225091-A Ethylene alpha-olefin polymer substituted thiocarboxylic acid lubricant dispersant additives EXXON CHEMICAL PATENTS INC. (US) 1993-07-06 US disclosed
US-5175256-A Protein labeling reagents NEORX CORPORATION (US) 1992-12-29 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-20090163697-A1 Multicomponent coupling and glycopeptide synthesis with cyclic thioanhydrides LNPEP, CLSPN, GALNT14 ALDH1A1 4243/4885TSHR 395/4885PRSS1 2225/4885

“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.