SCHEMBL1783577

SCHEMBL1783577

CC(C)C(C)CCC=O

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
SCHEMBL11764505 0.85 ALDH1A1 (0.32)
SCHEMBL1784414 0.83 HIF1A (0.45)
SCHEMBL1784484 0.81 TSHR (0.44)
SCHEMBL1781622 0.79 TSHR (0.48)
SCHEMBL10629761 0.79 TSHR (0.48)
SCHEMBL6444472 0.78 ALDH1A1 (0.35)
SCHEMBL1787215 0.78 ALDH1A1 (0.41)
SCHEMBL1783887 0.78 ALDH1A1 (0.48)
SCHEMBL1752617 0.78
SCHEMBL1751706 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116375567-A Method for manufacturing multi-branched high carbonic acid 浙江信汇新材料股份有限公司 2023-07-04 CN claimed
CN-115135691-A Method for producing aromatic diethers and corresponding method for producing polyaryletherketones 阿科玛法国公司 2022-09-30 CN claimed
CN-116375567-B Method for manufacturing multi-branched high carbonic acid 浙江信汇新材料股份有限公司 2024-03-26 CN disclosed
CN-116375567-A Method for manufacturing multi-branched high carbonic acid 浙江信汇新材料股份有限公司 2023-07-04 CN disclosed
CN-115135691-A Method for producing aromatic diethers and corresponding method for producing polyaryletherketones 阿科玛法国公司 2022-09-30 CN disclosed
CN-102272078-B Method for producing polymethylols BASF SE 2015-06-03 CN disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
CN-101583587-B Process for preparing polyalcohols from formaldehyde with a low formic acid content BASF SE 2012-08-08 CN disclosed
CN-102272078-A Method for producing polymethylols 2011-12-07 CN disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
CN-101583587-A Process for preparing polyalcohols from formaldehyde with a low formic acid content BASF SE (DE) 2009-11-18 CN disclosed
US-20080167506-A1 of by-products can advantageously be prevented in a targeted manner and the yield of the desired polymethylol compound can thereby be increased; condensing an aldehyde with formaldehyde in an aldol reaction to form an alkanal, hydrogenating the alkanal BASF AKTIENGESELLSCHAFT (DE) 2008-07-10 US disclosed
CN-1227200-C Method for removing acetals containing formaldehyde from polyvalent alcohols by means of tempering BASF AG (DE) 2005-11-16 CN disclosed
CN-1558889-A Method for removing acetals containing formaldehyde from polyvalent alcohols by means of tempering �����ɷ� 2004-12-29 CN disclosed
EP-1209147-A1 CARBOXYLIC ACID DERIVATIVES AND ADHESION MOLECULE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2002-05-29 EP disclosed
US-6040465-A Process for producing optically active β-lactones TAKASAGO INTERNATIONAL CORPORATION (JP) 2000-03-21 US disclosed
US-5998635-A CATALYTIC CYCLIZATION AN ALDEHYDE WITH A KETENE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-07 US disclosed
EP-0142090-B1 PROCESS FOR THE PREPARATION OF TRIMETHYLOL ALCANES FROM ALCANOLS AND FORMALDEHYDE BASF Aktiengesellschaft (DE) 1988-06-15 EP disclosed
US-4594461-A Preparation of trimethylolalkanes from alkanals and formaldehyde BASF AKTIENGESELLSCHAFT (DE) 1986-06-10 US disclosed
EP-0142090-A2 Process for the preparation of trimethylol alcanes from alcanols and formaldehyde BASF Aktiengesellschaft (DE) 1985-05-22 EP disclosed