SCHEMBL142029

SCHEMBL142029

CC(C)NC(=O)C(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
Hydrochloric Acid SCHEMBL28967104 0.97 CA12 (0.42)
SCHEMBL22916996 0.89 MMP9 (0.37)
SCHEMBL22916911 0.84 CA12 (0.39)
SCHEMBL21168597 0.84 CA12 (0.39)
SCHEMBL19485944 0.81
SCHEMBL5018136 0.81 CA1 (0.40)
SCHEMBL22651865 0.79 ACE (0.50)
SCHEMBL16105468 0.78
SCHEMBL20953667 0.78 HIF1A (0.43)
SCHEMBL19661874 0.78 HIF1A (0.43)

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 1596 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113840820-B Phthalazinone compounds and uses thereof ST制药株式会社 2024-05-03 CN claimed
EP-3590933-B1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2021-01-06 EP claimed
EP-3416965-B1 PROCESS FOR PREPARING 7H-PYRROLO [2,3-D]PYRIMIDINE COMPOUNDS ZOETIS SERVICES LLC (US) 2020-10-07 EP claimed
EP-2638031-B9 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2020-01-08 EP claimed
EP-3124483-B1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2019-07-10 EP claimed
CN-108347939-A Fungicidal composition containing the 2,4- dioxo -1,4- dihydro-thiophenes simultaneously derivative of [2,3-D] pyrimidine 吉利德阿波罗公司 2018-07-31 CN claimed
EP-2638031-B1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2017-10-11 EP claimed
EP-3124483-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS F. Hoffmann-La Roche AG (CH) 2017-02-01 EP claimed
US-9527042-B2 Separation membrane for water treatment and production method for same TORAY INDUSTRIES, INC. (JP) 2016-12-27 US claimed
CN-103313978-B Pyrazole aminopyrimidine derivatives as LRRK2 modulators HOFFMANN LA ROCHE 2015-04-15 CN claimed
US-8815882-B2 Pyrazole aminopyrimidine derivatives as LRRK2 modulators GENENTECH, INC. (US) 2014-08-26 US claimed
EP-2671628-A1 SEPARATION MEMBRANE FOR WATER TREATMENT AND PRODUCTION METHOD FOR SAME Toray Industries, Inc. (JP) 2013-12-11 EP claimed
US-20130284664-A1 SEPARATION MEMBRANE FOR WATER TREATMENT AND PRODUCTION METHOD FOR SAME TORAY INDUSTRIES, INC. (JP) 2013-10-31 US claimed
US-20120157427-A1 PYRAZOLE AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2012-06-21 US claimed
WO-2011000945-A9 AMINOALKAMIDES FOR USE IN THE TREATMENT OF INFLAMMATORY, DEGENERATIVE OR DEMYELINATING DISEASES OF THE CNS NENSIUS RESEARCH A/S (DK) 2011-04-07 WO claimed
WO-2011000945-A2 AMINOALKAMIDES FOR USE IN THE TREATMENT OF INFLAMMATORY, DEGENERATIVE OR DEMYELINATING DISEASES OF THE CNS NENSIUS RESEARCH A/S (DK) 2011-01-06 WO claimed
EP-0406714-B1 METHOD FOR THE PRODUCTION OF CARBOXYLIC ACID CHLORIDES BASF Aktiengesellschaft (DE) 1993-05-12 EP claimed
EP-0406714-A1 Method for the production of carboxylic acid chlorides BASF Aktiengesellschaft (DE) 1991-01-09 EP claimed
US-12630731-B2 Non-aqueous ink composition DNP FINE CHEMICALS CO., LTD. (JP) 2026-05-19 US disclosed
EP-0031504-A1 Process for the preparation of carboxylic acid chlorides BASF Aktiengesellschaft (DE) 1981-07-08 EP disclosed