SCHEMBL283731

SCHEMBL283731

COC(=O)C(C)SSC(C)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
CA14 Q9ULX7 2/20 0.42
CA12 O43570 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32

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
SCHEMBL8603710 0.89 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2CA14CA12KDM4E
SCHEMBL112203 0.82 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2CA14CA12KDM4E
SCHEMBL1171502 0.80
SCHEMBL10435532 0.78
SCHEMBL18312129 0.78
SCHEMBL13563301 0.78 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2CA14KDM4EHPGD
SCHEMBL15301371 0.76 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CA14CA12KDM4E
SCHEMBL15301372 0.76 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2CA14CA12KDM4E
SCHEMBL6467692 0.76 CA14 (0.43) ALDH1A1SMN1; SMN2CA14KDM4EHPGD
SCHEMBL5414052 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120053735-A Self-healing hydrogel for skin repair and preparation method thereof 武汉纺织大学 2025-05-30 CN claimed
CN-118725515-A Nanometer high weather-proof insulating agent 安徽云德科技发展有限公司 2024-10-01 CN claimed
CN-116200837-B China hemp fiber for regenerated seeds and preparation method thereof 山东银鹰化纤有限公司 2024-07-30 CN claimed
CN-118221964-A Self-healing hydrogel with rapid gel capability and preparation method thereof 武汉纺织大学 2024-06-21 CN claimed
CN-118221963-A High-strength self-healing hydrogel with rapid gel capability and preparation method thereof 武汉纺织大学 2024-06-21 CN claimed
CN-118222013-A Hyaluronic acid-based hydrogel with rapid gel ability and high self-healing efficiency and preparation method thereof 武汉纺织大学 2024-06-21 CN claimed
CN-117778546-A Agricultural product microorganism rapid detection system and method thereof 王丽波 2024-03-29 CN claimed
CN-113582941-B Preparation method of 4, 5-dichloro-2-n-octyl-3-isothiazolinone 广州合成材料研究院有限公司 2023-09-08 CN claimed
CN-116200837-A China hemp fiber for regenerated seeds and preparation method thereof 山东银鹰化纤有限公司 2023-06-02 CN claimed
CN-114853646-A Method for synthesizing dimethyl dithiodipropionate based on continuous vulcanization reaction 山东裕滨新材料有限公司 2022-08-05 CN claimed
US-8592356-B2 Lubricant composition for internal combustion engine IDEMITSU KOSAN CO., LTD. (JP) 2013-11-26 US claimed
US-8309499-B2 Lubricant composition for internal combustion engine IDEMITSU KOSAN CO., LTD. (JP) 2012-11-13 US claimed
EP-1810966-B1 ALKOXYPROPYL ISOTHIAZOLINONE AND PREPARATION METHOD AND USE THEREOF OCEAN UNIV CHINA (CN) 2012-04-25 EP claimed
US-7442240-B2 Alkoxylpropylisothiazolinone and preparation method and use thereof OCEAN UNIVERSITY OF CHINA (CN) 2008-10-28 US claimed
US-20070256596-A1 Alkoxylpropylisothiazolinone and Preparation Method and Use Thereof OCEAN UNIVERSITY OF CHINA (CN) 2007-11-08 US claimed
EP-1810966-A1 ALKOXYPROPYL ISOTHIAZOLINONE AND PREPARATION METHOD AND USE THEREOF Ocean University of China (CN) 2007-07-25 EP claimed
EP-0507602-A1 Thioester polymerization modifiers WITCO CORPORATION (US) 1992-10-07 EP claimed
EP-0279667-A2 Process for the removal of hydrogen sulfide and optionally carbon dioxide from gaseous streams THE DOW CHEMICAL COMPANY (US) 1988-08-24 EP claimed
US-4067901-A FROM ACRYLIC ESTER, HYDROGEN SULFIDE, SULFUR; AMINE CATALYST WITCO CHEMICAL CORPORATION (US) 1978-01-10 US claimed
US-4052440-A AMMONIA OR AMINE CATALYST WITCO CHEMICAL CORPORATION (US) 1977-10-04 US claimed

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-20070256596-A1 Alkoxylpropylisothiazolinone and Preparation Method and Use Thereof TST, MGMT, MPST ALDH1A1 1585/4885SMN1; SMN2 4708/4885CA14 912/4885

“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.