SCHEMBL198933

SCHEMBL198933

[CH2]CC(=O)N(CC)CC

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
SCHEMBL5204543 0.85 CA12 (0.44)
SCHEMBL5205770 0.81 CA1 (0.45)
SCHEMBL5206297 0.81 CA12 (0.55)
SCHEMBL231479 0.78 LMNA (0.64)
SCHEMBL5207774 0.78 ALDH1A1 (0.52)
SCHEMBL8437535 0.78 LMNA (0.35)
SCHEMBL224316 0.77
SCHEMBL139066 0.75
SCHEMBL2327551 0.75 LMNA (0.78)
SCHEMBL6244448 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240240229-A1 METHODS OF ADMINISTERING MONOMETHYL FUMARATE AND PRODRUGS THEREOF HAVING REDUCED SIDE EFFECTS HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2024-07-18 US claimed
US-20240197661-A1 ORAL DOSAGE FORMS OF METHYL HYDROGEN FUMARATE AND PRODRUGS THEREOF HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2024-06-20 US claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
US-20240139160-A1 PHARMACEUTICAL COMBINATION COMPRISING A SELECTIVE S1P1 RECEPTOR AGONIST VANDA PHARMACEUTICALS INC. 2024-05-02 US claimed
US-20240131009-A1 PHARMACEUTICAL COMBINATION COMPRISING A SELECTIVE S1P1 RECEPTOR AGONIST ACTELION PHARMACEUTICALS LTD (CH) 2024-04-25 US claimed
US-20240024249-A1 ORAL DOSAGE FORMS HAVING A HIGH LOADING OF A METHYL HYDROGEN FUMARATE PRODRUG HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2024-01-25 US claimed
US-20230123588-A1 METHODS OF SLOWING BRAIN VOLUME LOSS VANDA PHARMACEUTICALS INC. 2023-04-20 US claimed
EP-4114388-A1 METHODS OF SLOWING BRAIN VOLUME LOSS Actelion Pharmaceuticals Ltd (CH) 2023-01-11 EP claimed
US-11135296-B2 Pharmaceutical compositions of fumaric acid esters ARBOR PHARMACEUTICALS, LLC (US) 2021-10-05 US claimed
WO-2021176070-A1 METHODS OF SLOWING BRAIN VOLUME LOSS ACTELION PHARMACEUTICALS LTD (CH) 2021-09-10 WO claimed
WO-2004056784-A1 NOVEL CARBOXAMIDES, THE PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-07-08 WO claimed
US-5859190-A SOLID PHASE SYNTHESIS TO FORM A PROTECTED DIPEPTIDE FOLLOWED BY REACTING WITH 1,1'-THIOCARBONYLDIIMIDAZOLE TO EFFECT RING FORMATION; EFFICIENCY; ANTICONVULSANT,-ARRHYTHMIC AND DIABETIC AGENTS; HERBICIDES AND FUNGICIDES TREGA BIOSCIENCES, INC. (US) 1999-01-12 US claimed
WO-1998033776-A1 COMBINATORIAL LIBRARIES OF HYDANTOIN AND THIOHYDANTOIN DERIVATIVES, METHODS OF MAKING THE LIBRARIES AND COMPOUNDS THEREIN TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
EP-0832082-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1998-04-01 EP claimed
EP-0749964-A1 N-Heterocyclyl biphenyl sulfonamides ZENECA LIMITED (GB) 1996-12-27 EP claimed
WO-1996040681-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1996-12-19 WO claimed
EP-0517052-A1 Substituted imidazolinyl-pyrimidines BAYER AG (DE) 1992-12-09 EP claimed
EP-0077963-A1 2-Nitro-5-(4-trifluoromethyl-phenoxy)-benzyl derivatives, process for their preparation, and their use as herbicides and plant growth regulators BAYER AG (DE) 1983-05-04 EP claimed
US-4315855-A Monoazo disperse dyes containing a nitrophenyl group and a homophthalimide group BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US claimed
US-4102886-A REACTING A SECONDARY AMINE AND A BENZO(A)QUINOLIZIDINE, REACTING THE PRODUCT WITH AN UNSATURATED NITRILE, ACID, OR ESTER CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1978-07-25 US claimed