SCHEMBL128479

SCHEMBL128479

CC(C)C[N]CC(C)C

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
SCHEMBL270795 0.81
SCHEMBL3166165 0.78
SCHEMBL7054428 0.75 TRPA1 (0.33)
SCHEMBL7057706 0.73 TRPA1 (0.32)
SCHEMBL1487502 0.73 TRPA1 (0.42)
SCHEMBL166950 0.73 TRPA1 (0.42)
SCHEMBL7058843 0.71 LMNA (0.39)
SCHEMBL129076 0.70
SCHEMBL1792536 0.67
SCHEMBL10089592 0.67

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

Appears in 5364 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324980-A Supported bifunctional polymer metalloporphyrin complex, preparation method and application 中国科学院长春应用化学研究所 2024-07-12 CN claimed
CN-114450284-B 6, 7-Dihydro-5H-pyrido [2,3-C ] pyridazine derivatives as BCL-XL protein inhibitors 法国施维雅药厂 2024-05-07 CN claimed
EP-4003989-B1 6,7-DIHYDRO-5H-PYRIDO[2,3-C]PYRIDAZINE DERIVATIVES AND RELATED COMPOUNDS AS BCL-XL PROTEIN INHIBITORS AND PRO-APOPTOTIC AGENTS FOR TREATING CANCER SERVIER LAB (FR) 2023-12-27 EP claimed
CN-117209545-A Preparation method of film containing IV group metal element and precursor composition thereof 大连恒坤新材料有限公司 2023-12-12 CN claimed
US-20220363549-A1 AMORPHOUS SILICON FORMING COMPOSITION AND METHOD FOR PRODUCING AMORPHOUS SILICON FILM USING SAME MERCK PATENT GMBH (DE) 2022-11-17 US claimed
CN-114729226-A Composition for forming amorphous silicon and method for producing amorphous silicon film using the same 默克专利有限公司 2022-07-08 CN claimed
EP-4003989-A1 6,7-DIHYDRO-5H-PYRIDO[2,3-C]PYRIDAZINE DERIVATIVES AND RELATED COMPOUNDS AS BCL-XL PROTEIN INHIBITORS AND PRO-APOPTOTIC AGENTS FOR TREATING CANCER Les Laboratoires Servier (FR) 2022-06-01 EP claimed
CN-114450284-A 6, 7-dihydro-5H-pyrido [2,3-C ] pyridazine derivatives and related compounds as BCL-XL protein inhibitors and pro-apoptotic agents for the treatment of cancer 法国施维雅药厂 2022-05-06 CN claimed
WO-2021099356-A1 AMORPHOUS SILICON FORMING COMPOSITION AND METHOD FOR PRODUCING AMORPHOUS SILICON FILM USING SAME MERCK PATENT GMBH (DE) 2021-05-27 WO claimed
CN-107540664-B Pyrazolyl pyrimidine ether compound and application thereof 沈阳中化农药化工研发有限公司 2021-02-26 CN claimed
EP-0465901-A1 2-Acylamino-7-chlorobenzothiazoles BAYER AG (DE) 1992-01-15 EP claimed
US-4954499-A Pyridazinone derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-09-04 US claimed
EP-0076199-B1 TRIAZOLOQUINAZOLONES AND THEIR SALTS, PROCESS AND INTERMEDIATES FOR PREPARING THEM, THEIR USE AS MEDICINES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1986-12-30 EP claimed
EP-0087000-B1 N-OXALYL DERIVATIVES OF N-METHYL CARBAMATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1985-11-13 EP claimed
EP-0132676-A2 Phosphoric or phosphonic acid esters BAYER AG (DE) 1985-02-13 EP claimed
US-4472400-A Triazoloquinazolones having antihistaminic and bronchospasmolytic activity ROUSSEL UCLAF (FR) 1984-09-18 US claimed
EP-0100476-A2 Phosphoric-acid esters, process for their preparation and their use as pesticides BAYER AG (DE) 1984-02-15 EP claimed
EP-0076199-A2 Triazoloquinazolones and their salts, process and intermediates for preparing them, their use as medicines and compositions containing them ROUSSEL-UCLAF (FR) 1983-04-06 EP claimed
US-4341551-A HERBICIDES, FUNGICIDES, PLANT GROWTH REGULATORS SCHERING AG (DE) 1982-07-27 US claimed
US-4004008-A ANTISPASMODIC, VASODILATION ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1977-01-18 US claimed