SCHEMBL461574

SCHEMBL461574

C=CCc1nc(N)n[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
SCHEMBL5682557 0.74
SCHEMBL4750890 0.72
SCHEMBL1930807 0.70
SCHEMBL535715 0.70
SCHEMBL1101441 0.69 NPSR1 (0.41)
SCHEMBL17950129 0.68
SCHEMBL1101374 0.68 NPSR1 (0.40)
SCHEMBL8519330 0.65 MEN1 (0.40)
SCHEMBL5924128 0.65 ALDH1A1 (0.47)
SCHEMBL10362767 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000077139-A1 MACHINE DISHWASHING DETERGENTS CONTAINING SPECIAL PHOSPHATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-12-21 WO claimed
EP-0854183-A1 Automatic dishwashing compositon with silver protection agent Henkel Kommanditgesellschaft auf Aktien (DE) 1998-07-22 EP claimed
EP-0162875-B1 CORROSION INHIBITORS FOR ALUMINIUM Henkel Kommanditgesellschaft auf Aktien (DE) 1989-02-15 EP claimed
US-4647429-A Corrosion inhibitors for aluminum HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1987-03-03 US claimed
EP-0025863-B1 USE OF 1,2,4-TRIAZOLE DERIVATIVES AS CORROSION INHIBITORS FOR NON FERROUS METALS Henkel Kommanditgesellschaft auf Aktien (DE) 1983-10-12 EP claimed
US-4298568-A 3-AMINO-5-ALKYL-1,2,4-TRIAZOLE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1981-11-03 US claimed
EP-2118255-B2 DETERGENTt COMPOSITION HENKEL AG & CO KGAA (DE) 2024-05-15 EP disclosed
EP-4345155-A1 PRESSED PHASE GEL DISH DETERGENT PORTION UNIT Henkel AG & Co. KGaA (DE) 2024-04-03 EP disclosed
EP-1776448-B2 METHOD FOR PRODUCING PORTIONED DETERGENTS OR CLEANING AGENTS HENKEL AG & CO KGAA (DE) 2023-10-11 EP disclosed
EP-3164477-B1 CLEANING AGENT COMPRISING A GLASS CORROSION INHIBITOR HENKEL AG & CO KGAA (DE) 2021-04-21 EP disclosed
EP-2414498-B1 CLEANING AGENT HENKEL AG & CO KGAA (DE) 2020-12-09 EP disclosed
EP-3567094-A1 CLEANING PRODUCT Henkel AG & Co. KGaA (DE) 2019-11-13 EP disclosed
EP-2115112-B1 DETERGENTS HENKEL AG & CO KGAA (DE) 2019-07-03 EP disclosed
EP-0162875-A1 CORROSION INHIBITORS FOR ALUMINIUM. HENKEL KGAA (DE) 1985-12-04 EP disclosed
WO-1985002207-A1 CORROSION INHIBITORS FOR ALUMINIUM HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1985-05-23 WO disclosed
EP-0025863-B1 USE OF 1,2,4-TRIAZOLE DERIVATIVES AS CORROSION INHIBITORS FOR NON FERROUS METALS Henkel Kommanditgesellschaft auf Aktien (DE) 1983-10-12 EP disclosed
US-4298568-A 3-AMINO-5-ALKYL-1,2,4-TRIAZOLE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1981-11-03 US disclosed
US-4298568-A 3-AMINO-5-ALKYL-1,2,4-TRIAZOLE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1981-11-03 US disclosed
EP-0025863-A1 Use of 1,2,4-triazole derivatives as corrosion inhibitors for non ferrous metals Henkel Kommanditgesellschaft auf Aktien (DE) 1981-04-01 EP disclosed
EP-0025863-A1 Use of 1,2,4-triazole derivatives as corrosion inhibitors for non ferrous metals Henkel Kommanditgesellschaft auf Aktien (DE) 1981-04-01 EP disclosed