SCHEMBL4516857

SCHEMBL4516857

CC(=O)N1CCC(=S)[C@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.39
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
HHAT Q5VTY9 1/20 0.35
MTNR1B P49286 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
SIRT1 Q96EB6 1/20 0.32
ACE P12821 2/20 0.32
MMP2 P08253 2/20 0.30
ANPEP P15144 1/20 0.30
NOTUM Q6P988 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
Acetylcysteine SCHEMBL5080784 0.81 SMN1; SMN2 (0.53) SMN1; SMN2ACE
SCHEMBL691494 0.76 HSD17B10 (0.41) SMN1; SMN2
SCHEMBL8893574 0.74 L3MBTL1 (0.43) TSHRKMT2ASMN1; SMN2CYP2C19ACE
SCHEMBL28681399 0.67 HHAT (0.46) POLBHHATMTNR1BACE
SCHEMBL21515965 0.64 SIRT1 (0.42) POLBHHATMTNR1BSMN1; SMN2SIRT1
SCHEMBL17541277 0.63
SCHEMBL992740 0.63
SCHEMBL6518287 0.61 ATM (0.47) POLBATMACEMMP2ANPEP
SCHEMBL22636529 0.61 ACE (0.32) POLBACE
SCHEMBL22636530 0.61 ACE (0.32) POLBACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008012756-A2 PEST ATTRACTANT COMPOSITION ACTIVETRAD (PROPRIETARY) LIMITED (ZA) 2008-01-31 WO claimed
CN-121449569-B Acetylthioproline anthracene methyl ester for photosensitive resin composition and application thereof 湖南初源新材料股份有限公司 2026-04-17 CN disclosed
CN-121449569-A Acetylthioproline anthracene methyl ester for photosensitive resin composition and application thereof 湖南初源新材料股份有限公司 2026-02-03 CN disclosed
US-20240237648-A1 SYNERGISTIC OIL DISPERSION AGROCHEMICAL COMPOSITION CONTAINING SPINETORAM RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2024-07-18 US disclosed
US-20240206459-A1 SYNERGISTIC AGROCHEMICAL OIL DISPERSION FORMULATION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2024-06-27 US disclosed
WO-2022249204-A1 SYNERGISTIC OIL DISPERSION AGROCHEMICAL COMPOSITION CONTAINING SPINETORAM RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2022-12-01 WO disclosed
WO-2022224275-A1 SYNERGISTIC AGROCHEMICAL OIL DISPERSION FORMULATION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2022-10-27 WO disclosed
CN-114711247-A Agricultural composition containing lecithin and hemiphyllin 渭南东旺农华生物科技有限公司 2022-07-08 CN disclosed
CN-110881468-B Crop growth regulator composition and application thereof 郑州郑氏化工产品有限公司 2021-07-30 CN disclosed
CN-110881468-A Crop growth regulator composition and application thereof 郑州郑氏化工产品有限公司 2020-03-17 CN disclosed
EP-1135371-A1 BETA-ALANINE DERIVATIVES AS ALPHA 4 INTEGRIN INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 2001-09-26 EP disclosed
EP-1095036-A1 CINNAMIC ACID DERIVATIVES AS CELL ADHESION MOLECULES CELLTECH THERAPEUTICS LIMITED (GB) 2001-05-02 EP disclosed
EP-1066316-A1 CINNAMIC ACID DERIVATIVES HAVING CELL ADHESION MODULATING ACTIVITY CELLTECH THERAPEUTICS LIMITED (GB) 2001-01-10 EP disclosed
WO-2000032575-A1 β-ALANINE DERIVATIVES AS α4 INTEGRIN INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 2000-06-08 WO disclosed
WO-2000001690-A1 CINNAMIC ACID DERIVATIVES AS CELL ADHESION MOLECULES CELLTECH THERAPEUTICS LIMITED (GB) 2000-01-13 WO disclosed
WO-1999047547-A1 CINNAMIC ACID DERIVATIVES HAVING CELL ADHESION MODULATING ACTIVITY CELLTECH THERAPEUTICS LIMITED (GB) 1999-09-23 WO disclosed
US-5591758-A ANGINA PECTORIS TREATMENT LABORATOIRES HOECHST, SA (FR) 1997-01-07 US disclosed
EP-0604459-A1 Organic nitrates, methods for preparing same and use thereof for treating cardiovascular diseases LABORATOIRES HOECHST S.A. (FR) 1994-07-06 EP disclosed
EP-0530887-A1 Organic nitrates, processes for their preparation and their use in the treatment of cardiovascular diseases LABORATOIRES HOECHST S.A. (FR) 1993-03-10 EP disclosed
WO-1993003037-A1 ORGANIC NITRATES, METHODS FOR PREPARING SAME AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES LABORATOIRES HOECHST, SOCIÉTÉ ANONYME (FR) 1993-02-18 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 (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-20240206459-A1 SYNERGISTIC AGROCHEMICAL OIL DISPERSION FORMULATION DDT, SQLE, SCD POLB 1915/4885ATM 875/4885MEN1 3937/4885
US-20240237648-A1 SYNERGISTIC OIL DISPERSION AGROCHEMICAL COMPOSITION CONTAINING SPINETORAM IPO9, PDE12, SOST POLB 3998/4885ATM 1785/4885MEN1 2352/4885

“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.