SCHEMBL166882

SCHEMBL166882

Cc1n[nH]c(=O)[nH]1

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
SCHEMBL814784 0.71
SCHEMBL92519 0.63
SCHEMBL13217143 0.63
SCHEMBL1928370 0.62
SCHEMBL19347197 0.62
SCHEMBL22761418 0.60
SCHEMBL19429460 0.60 TSHR (0.43)
SCHEMBL4621674 0.59
SCHEMBL14941633 0.59
SCHEMBL15564067 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233849-A1 HETEROARYLALKYLENE ARYL SULTAM DERIVATIVES AS RORc MODULATORS F. Hoffmann-La Roche AG (CH) 2017-10-25 EP claimed
WO-2016096936-A1 HETEROARYLALKYLENE ARYL SULTAM DERIVATIVES AS RORc MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2016-06-23 WO claimed
EP-0734381-B1 MORPHOLINE TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2000-07-05 EP claimed
US-12110279-B2 Triazolones, tetrazolones, and imidazolones, or their salts, and pharmaceutical compositions comprising the same YUHAN CORPORATION (KR) 2024-10-08 US disclosed
EP-4326715-A1 TRIAZOLONES, TETRAZOLONES, AND IMIDAZOLONES, OR THEIR SALTS, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Yuhan Corporation (KR) 2024-02-28 EP disclosed
CN-117203205-A Triazolone, tetrazolone and imidazolone or salts thereof, and pharmaceutical compositions containing the same 柳韩洋行 2023-12-08 CN disclosed
US-20230340018-A1 MPRO CYSTEINE PROTEASE INHIBITORS ANIXA BIOSCIENCES, INC. 2023-10-26 US disclosed
WO-2023205424-A2 LIPID COMPOSITIONS AND METHODS FOR NUCLEIC ACID DELIVERY GREENLIGHT BIOSCIENCES, INC. (US) 2023-10-26 WO disclosed
EP-3483143-B1 PIPERIDINONE DERIVATIVES AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC (US) 2023-10-18 EP disclosed
US-11786608-B2 Isoquinolinyl triazolone complexes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-17 US disclosed
EP-3377474-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-08-16 EP disclosed
US-5965742-A Selective chlorination of a 1-(2-fluorophenyl)-1,2,4-triazole FMC CORPORATION (US) 1999-10-12 US disclosed
US-5965742-A Selective chlorination of a 1-(2-fluorophenyl)-1,2,4-triazole FMC CORPORATION (US) 1999-10-12 US disclosed
EP-0889882-A1 SELECTIVE CHLORINATION OF A 1-(2-FLUOROPHENYL)-1,2,4-TRIAZOLE FMC CORPORATION (US) 1999-01-13 EP disclosed
EP-0889882-A1 SELECTIVE CHLORINATION OF A 1-(2-FLUOROPHENYL)-1,2,4-TRIAZOLE FMC CORPORATION (US) 1999-01-13 EP disclosed
CN-1203591-A Selective chlorination of 1-(2-fluorophenyl)-1,2,4-triazole FMC CORP (US) 1998-12-30 CN disclosed
CN-1203591-A Selective chlorination of 1-(2-fluorophenyl)-1,2,4-triazole FMC CORP (US) 1998-12-30 CN disclosed
WO-1997024337-A1 SELECTIVE CHLORINATION OF A 1-(2-FLUOROPHENYL)-1,2,4-TRIAZOLE FMC CORPORATION (US) 1997-07-10 WO disclosed
WO-1997024337-A1 SELECTIVE CHLORINATION OF A 1-(2-FLUOROPHENYL)-1,2,4-TRIAZOLE FMC CORPORATION (US) 1997-07-10 WO disclosed
US-5468868-A Process for the selective chlorination of 4,5-dihydro-1-phenyl-1H-1,2,4-triazol-5-one FMC CORPORATION (US) 1995-11-21 US disclosed