SCHEMBL452517

SCHEMBL452517

Cc1nnsc1C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Hydrochloric Acid SCHEMBL6602988 0.98 LMNA (0.51)
SCHEMBL7784009 0.87 LMNA (0.51)
SCHEMBL7662834 0.87 LMNA (0.44)
SCHEMBL7491670 0.87 MAPT (0.51)
SCHEMBL11571174 0.81 MAPT (0.52)
SCHEMBL11572832 0.80 LMNA (0.46)
4-Chloroaniline SCHEMBL11573070 0.80 MAPT (0.57)
SCHEMBL11570071 0.80 POLB (0.49)
SCHEMBL4779258 0.79
SCHEMBL7784005 0.79 LMNA (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122074591-A Novel feed for replacing corn 2026-05-26 CN claimed
CN-119930651-A Thiazolopiperidine-containing derivative, and preparation method and application thereof 南开大学 2025-05-06 CN claimed
CN-116076503-B Application of crocetin diester in resisting tobacco mosaic virus 江西省科学院应用化学研究所 2025-05-02 CN claimed
CN-116789620-B Aryl-containing saturated gamma-butyrolactone compound, preparation method thereof and application thereof in resisting plant viruses 西北农林科技大学 2024-09-10 CN claimed
CN-110167944-B Substituted pyrazoloazepin-4-ones and their use as phosphodiesterase inhibitors 联合疗法公司 2024-08-23 CN claimed
CN-118290434-A Spiropiperidine derivative containing alpha-methylene-gamma-butyrolactone, preparation method and application thereof 南开大学 2024-07-05 CN claimed
CN-117343077-A Isoindolinone morpholine derivative and preparation method and application thereof 南开大学 2024-01-05 CN claimed
CN-116789620-A Aryl-containing saturated gamma-butyrolactone compound, preparation method thereof and application thereof in resisting plant viruses 西北农林科技大学 2023-09-22 CN claimed
CN-116768796-A Novel pyrazole-3-carboxamide derivative and preparation method and application thereof 河北农业大学 2023-09-19 CN claimed
CN-116076503-A Application of crocetin diester in resisting tobacco mosaic virus 江西省科学院应用化学研究所 2023-05-09 CN claimed
US-20050107436-A1 phenyl and pyridyl derivatives such as 3-Fluoro-N-(2'-trifluoromethyl-biphenyl-4-yl)-isonicotinamide, used as immunosuppressants for the treatmet or prevent inflammatory and immune disorders SYNTA PHARMACEUTICALS CORP. 2005-05-19 US claimed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US claimed
WO-2005037216-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PRODUCTS INC. (US) 2005-04-28 WO claimed
WO-2005009954-A2 METHOD FOR MODULATING CALCIUM ION-RELEASE-ACTIVATED CALCIUM ION CHANNELS SYNTA PHARMACEUTICALS, CORP. (US) 2005-02-03 WO claimed
WO-2005009539-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS, CORP. (US) 2005-02-03 WO claimed
US-20040014766-A1 Amide substituted xanthine derivatives HOFFMANN-LA ROCHE INC. 2004-01-22 US claimed
EP-0047560-B1 PROCESS FOR THE PREPARATION OF 7-ACYLAMINO-3-(THIO-SUBSTITUTED)METHYL-3-CEPHEM-4-CARBOXYLIC ACID 1-OXIDE DERIVATIVES GIST-BROCADES N.V. (NL) 1985-04-10 EP claimed
US-4379923-A Preparation of 7-acylamino-3-(thio-substituted)-methyl 3-cephem-4-carboxylic acid-1-oxide derivatives GIST-BROCADES N.V. (NL) 1983-04-12 US claimed
EP-0047560-A2 Process for the preparation of 7-acylamino-3-(thio-substituted)methyl-3-cephem-4-carboxylic acid 1-oxide derivatives GIST-BROCADES N.V. (NL) 1982-03-17 EP claimed
US-4177054-A PREEMERGENT AND POSTEMERGENT SCHERING AKTIENGESELLSCHAFT (DE) 1979-12-04 US claimed