SCHEMBL3746029

SCHEMBL3746029

N#CC(C#N)CP

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
SCHEMBL820002 0.67 TSHR (0.33)
SCHEMBL819832 0.67 ALDH1A1 (0.33)
Water SCHEMBL7591348 0.62
SCHEMBL632732 0.61
SCHEMBL21874813 0.61 TSHR (0.30)
SCHEMBL3243341 0.61
SCHEMBL819370 0.61 TSHR (0.30)
SCHEMBL1075894 0.61
SCHEMBL7961664 0.61
SCHEMBL20462495 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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445142-B2 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2013-05-21 US claimed
US-20100297508-A1 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2010-11-25 US claimed
US-8445142-B2 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2013-05-21 US disclosed
US-8445142-B2 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2013-05-21 US disclosed
US-20100297508-A1 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2010-11-25 US disclosed
US-20100297508-A1 Organic electrolytic solution and lithium battery employing the same SAMSUNG SDI CO., LTD. (KR) 2010-11-25 US disclosed
US-5366516-A Heterocyclic compounds useful as additives for lubricant and fuel compositions THE LUBRIZOL CORPORATION (US) 1994-11-22 US disclosed
US-5308520-A Improved fuel efficiency, unsaturated piperidine compounds THE LUBRIZOL CORPORATION (US) 1994-05-03 US disclosed
EP-0333705-B1 HETEROCYCLIC COMPOUNDS USEFUL AS ADDITIVES FOR LUBRICANT AND FUEL COMPOSITIONS The Lubrizol Corporation (US) 1991-10-02 EP disclosed
EP-0333705-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ADDITIVES FOR LUBRICANT AND FUEL COMPOSITIONS. LUBRIZOL CORP (US) 1989-09-27 EP disclosed
US-4784782-A FRICTION RESISTANCE THE LUBRIZOL CORPORATION (US) 1988-11-15 US disclosed
WO-1987005926-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ADDITIVES FOR LUBRICANT AND FUEL COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1987-10-08 WO disclosed
US-4071549-A Process for the preparation of bis-(beta-cyanoethyl) alkyl phosphine from tris-cyanoethyl phosphine MONSANTO COMPANY (US) 1978-01-31 US disclosed