SCHEMBL416901

SCHEMBL416901

[3H]NCl

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
Water SCHEMBL5311502 0.93
Water SCHEMBL2385555 0.93
SCHEMBL8757 0.71
SCHEMBL11367292 0.71
SCHEMBL906180 0.71
Phosphine SCHEMBL2689909 0.61
SCHEMBL19003097 0.61
SCHEMBL6478568 0.61
SCHEMBL2689914 0.61
SCHEMBL7535004 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861262-B2 Composition and method for detecting an adulterant in an aqueous sample QUEST DIAGNOSTICS INVESTMENTS INCORPORATED (US) 2005-03-01 US claimed
WO-2002099419-A1 COMPOSITION AND METHOD FOR DETECTING AN ADULTERANT IN AN AQUEOUS SAMPLE QUEST DIAGNOSTICS INC (US) 2002-12-12 WO claimed
US-20020106807-A1 Composition and method for detecting an adulterant in an aqueous sample QUEST DIAGNOSTICS, INC. 2002-08-08 US claimed
US-4227888-A Method for the quantitative determination of cyanide MONSANTO COMPANY (US) 1980-10-14 US claimed
US-3984406-A FROM AN ALKALI METAL PHTHALAMATE AND A HYPOHALITE IN A HALOGEN CATALYST BASF AKTIENGESELLSCHAFT (DT) 1976-10-05 US claimed
US-20240132525-A1 BORON CONTAINING PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2024-04-25 US disclosed
WO-2023244775-A1 BORON CONTAINING PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS AND USES THEREOF Boehringer Ingelheim Animal Health USA Inc. (US) 2023-12-21 WO disclosed
EP-3694422-A1 RADIOACTIVE LIQUID EMBOLIC Microvention, Inc. (US) 2020-08-19 EP disclosed
EP-2739596-B1 PROCESS FOR THE PRODUCTION OF CHLORINATED PROPENES BLUE CUBE IP LLC (US) 2019-05-01 EP disclosed
WO-2019074965-A1 RADIOACTIVE LIQUID EMBOLIC MICROVENTION, INC. (US) 2019-04-18 WO disclosed
EP-2739595-B1 PROCESS FOR THE PRODUCTION OF CHLORINATED PROPENES BLUE CUBE IP LLC (US) 2018-12-12 EP disclosed
EP-2739597-B1 PROCESS FOR THE PRODUCTION OF CHLORINATED PROPENES BLUE CUBE IP LLC (US) 2018-09-19 EP disclosed
EP-0105898-A1 METHOD FOR DETERMINING THE CONTENT OF COLLAGEN IN A SAMPLE CONTAINING CONNECTIVE TISSUE A/S N. Foss Electric (DK) 1984-04-25 EP disclosed
EP-0029300-B1 POLYPEPTIDES, ANTISERA CONTAINING THEM AND METHODS OF THEIR USE Addiction Research Foundation (US) 1984-01-18 EP disclosed
WO-1983003673-A1 METHOD FOR DETERMINING THE CONTENT OF COLLAGEN IN A SAMPLE CONTAINING CONNECTIVE TISSUE BJARNO, OLE-CHRISTIAN 1983-10-27 WO disclosed
US-4357310-A IMMUNOASSAY, LEUTOTROPIN BAXTER TRAVENOL LABORATORIES, INC. (US) 1982-11-02 US disclosed
US-4256629-A SPECIFICITY FOR HUMAN CHORIONIC GONADOTROPIN RESEARCH CORPORATION (US) 1981-03-17 US disclosed
US-4227888-A Method for the quantitative determination of cyanide MONSANTO COMPANY (US) 1980-10-14 US disclosed
US-4092306-A Oxidation of hydrazones to the corresponding diazo compounds in the presence of a phase transfer and an oxidation catalyst which is iodine, an iodide or an iodonium salt GLAXO LABORATORIES LIMITED (EN) 1978-05-30 US disclosed
US-4049609-A HYPOCHLORITE SINTETICA AMERICANA, INC. (US) 1977-09-20 US disclosed