SCHEMBL3832550

SCHEMBL3832550

CCC(C)CC(C)CN

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
SCHEMBL21577433 1.00
SCHEMBL26033217 1.00
SCHEMBL18754958 0.97 ALDH1A1 (0.35)
SCHEMBL2486901 0.87
SCHEMBL172570 0.83
SCHEMBL11332093 0.83 ALDH1A1 (0.44)
SCHEMBL107050 0.83
SCHEMBL1029711 0.83
SCHEMBL24736823 0.83
SCHEMBL83545 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111978198-B Oletum pteroic acid derivative and preparation method and application thereof 云南中医药大学 2023-10-27 CN claimed
CN-113843549-A Silver soldering paste sintering aid and preparation method and application thereof 深圳先进电子材料国际创新研究院 2021-12-28 CN claimed
US-4812500-A Polyolefin compositions for water pipes and for wire and cable coatings SHELL OIL COMPANY (US) 1989-03-14 US claimed
EP-3820846-B1 COMPOSITION FOR INHIBITING MONOMER POLYMERIZATION COMPRISING A NITROXIDE INHIBITOR, A QUINONE METHIDE RETARDER AND AN AMINE STABILIZER ECOLAB USA INC (US) 2024-01-03 EP disclosed
CN-111978198-B Oletum pteroic acid derivative and preparation method and application thereof 云南中医药大学 2023-10-27 CN disclosed
WO-2023205074-A1 PROCESSES AND INTERMEDIATES FOR SYNTHESIS OF ADAGRASIB Mirati Therapeutics, Inc. (US) 2023-10-26 WO disclosed
CN-113843549-A Silver soldering paste sintering aid and preparation method and application thereof 深圳先进电子材料国际创新研究院 2021-12-28 CN disclosed
US-11180578-B2 Polymerization inhibitor and retarder compositions with amine stabilizer ECOLAB USA INC. (US) 2021-11-23 US disclosed
CN-112533902-A Compositions comprising nitroxide inhibitors, quinone methide blockers and amine stabilizers to inhibit polymerization of monomers 埃科莱布美国股份有限公司 2021-03-19 CN disclosed
CN-111978198-A Lapterostigmatic acid derivative and preparation method and application thereof 云南中医药大学 2020-11-24 CN disclosed
US-10407528-B2 UV-absorbing polymers and formulations thereof ISP INVESTMENTS LLC (US) 2019-09-10 US disclosed
US-4122264-A Pyridine containing morpholines THE UPJOHN COMPANY (US) 1978-10-24 US disclosed
US-4115396-A HYPOTENSIVE AGENTS THE UPJOHN COMPANY (US) 1978-09-19 US disclosed
US-4113764-A Manufacture of N-substituted glycinonitriles BASF AKTIENGESELLSCHAFT (DE) 1978-09-12 US disclosed
US-4089672-A HERBICIDES THE UPJOHN COMPANY (US) 1978-05-16 US disclosed
US-4084955-A 1-CARBOXYALKYL-DI- AND TRIHALOPYRAZOLES, HERBICIDES THE UPJOHN COMPANY (US) 1978-04-18 US disclosed
US-4083849-A Process for preparation of 5-cyanopyrid-6-ones BASF AKTIENGESELLSCHAFT (DT) 1978-04-11 US disclosed
US-4067874-A Novel pyridine 1-oxides THE UPJOHN COMPANY (US) 1978-01-10 US disclosed
US-4022815-A Manufacture of substituted glycinonitriles BASF AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed
US-3995035-A 6-Amino-2-lower-alkyl-4-nitropyridine N-oxide compositions and coccidiostat process THE UPJOHN COMPANY (US) 1976-11-30 US disclosed