SCHEMBL1128735

SCHEMBL1128735

CC1(C)CC(=O)CC(O)C1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
PTPN1 P18031 1/20 0.36
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
ALOX15 P16050 1/20 0.34
PTPRC P08575 1/20 0.31
PTPRF P10586 1/20 0.31
PTPRM P28827 1/20 0.31
PTPN11 Q06124 1/20 0.31
PKM P14618 1/20 0.31
APLNR P35414 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL19311633 0.80 PTPN1 (0.35) PTPN1
SCHEMBL12440749 0.77 MAPT (0.37) MAPTALDH1A1POLBKDM4ETSHR
SCHEMBL10792327 0.76 MAPT (0.39) MAPTPTPN1ALDH1A1POLBKDM4E
SCHEMBL27781831 0.74 ALDH1A1 (0.42) MAPTALDH1A1KMT2APOLBKDM4E
SCHEMBL24862 0.74 ALDH1A1 (0.42) MAPTALDH1A1KMT2APOLBKDM4E
SCHEMBL4830509 0.74 PKM (0.32) PKM
SCHEMBL4868570 0.74 ALDH1A1 (0.42) MAPTALDH1A1KMT2APOLBKDM4E
Water SCHEMBL27960090 0.73 ALDH1A1 (0.41) MAPTALDH1A1KMT2APOLBKDM4E
SCHEMBL6430180 0.72 APLNR (0.56) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL570266 0.72

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113845452-B Synthesis method of trione compounds 沈阳中化农药化工研发有限公司 2024-03-12 CN disclosed
WO-2023171686-A1 SILANOL COMPOUND, PRODUCTION METHOD FOR SILANOL COMPOUND, AND COMPOSITION INCLUDING SILANOL COMPOUND 国立研究開発法人産業技術総合研究所 2023-09-14 WO disclosed
CN-113845452-A Synthetic method of triketone compound 沈阳中化农药化工研发有限公司 2021-12-28 CN disclosed
WO-2021163727-A1 PIKFYVE KINASE INHIBITORS AcuraStem Incorporated (US) 2021-08-19 WO disclosed
EP-2855441-B1 IMINO COMPOUNDS AS PROTECTING AGENTS AGAINST ULTRAVIOLET RADIATIONS ELKIMIA INC (CA) 2018-04-11 EP disclosed
CN-104203887-B The manufacture method of triphen phenols 本州化学工业株式会社 2016-09-21 CN disclosed
EP-2282980-B1 SYNTHESIS OF MONO-KETONES FROM 1,3-DIKETONES DSM IP ASSETS BV (NL) 2016-02-24 EP disclosed
CN-104203887-A Trisphenol production method HONSHU CHEMICAL IND 2014-12-10 CN disclosed
EP-1636236-B1 PYRAZOLO-QUINAZOLINE DERIVATIVES,PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 EP disclosed
EP-2282980-A1 SYNTHESIS OF MONO-KETONES FROM 1,3-DIKETONES DSM IP Assets B.V. (NL) 2011-02-16 EP disclosed
WO-2009144136-A1 SYNTHESIS OF MONO-KETONES FROM 1,3-DIKETONES DSM IP ASSETS B.V. (NL) 2009-12-03 WO disclosed
EP-0092044-B1 ROOM TEMPERATURE-CURABLE POLYORGANOSILOXANE COMPOSITIONS HAVING RESISTANCE TO SOILING Toray Silicone Company Limited (JP) 1987-07-15 EP disclosed
US-4486566-A ORGANOSULFONATE SILICON COMPOUND TORAY SILICONE CO., LTD. (JP) 1984-12-04 US disclosed
EP-0092044-A2 Room temperature-curable polyorganosiloxane compositions having resistance to soiling Toray Silicone Company Limited (JP) 1983-10-26 EP disclosed
EP-0081119-A1 Room temperature vulcanizable polyorganosiloxane compositions containing alcoholic and carboxylic organofunctionality Toray Silicone Company Limited (JP) 1983-06-15 EP disclosed