SCHEMBL9064427

SCHEMBL9064427

CC(=O)CC(C)=O.CC(C)O[Ti]OC(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
TSHR P16473 2/20 0.37
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
HTT P42858 1/20 0.32
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KDM6B O15054 1/20 0.31
KDM5C P41229 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31

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
SCHEMBL398895 1.00 MGAM (0.40) MGAMGAASIMGAM2TSHR
Acetoacetic Acid SCHEMBL27710791 0.89 KDM4E (0.37) MGAMGAASIMGAM2TSHR
SCHEMBL28374616 0.87 MGAM (0.62) MGAMGAASIMGAM2TSHR
SCHEMBL1277958 0.87 MGAM (0.62) MGAMGAASIMGAM2TSHR
Acetone SCHEMBL27692966 0.84 TSHR (0.43) TSHRALDH1A1TDP1
Acetone SCHEMBL27862164 0.84 TSHR (0.43) TSHRALDH1A1TDP1
SCHEMBL4580100 0.83 MGAM (0.41) MGAMGAASIMGAM2TSHR
SCHEMBL453462 0.82 GAA (0.50) MGAMGAASIMGAM2TSHR
SCHEMBL29036109 0.82 KDM4E (0.41) MGAMGAASIMGAM2ALDH1A1
SCHEMBL28370473 0.82 GAA (0.50) MGAMGAASIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104388042-B A kind of addition-type silicon rubber composition Guangzhou Huitian Fine Chemical Co., Ltd. (CN) 2016-04-13 CN claimed
CN-104388042-A Additional type silicone rubber composition GUANGZHOU HUITIAN FINE CHEMICAL CO LTD 2015-03-04 CN claimed
CN-109415501-A The manufacturing method of polymerization catalyst for polyester, polyester resin 日东化成株式会社 2019-03-01 CN disclosed
CN-108417922-A A method of being used to prepare solar cell from recycling lead of abandoned lead acid accumulator 华北电力大学 2018-08-17 CN disclosed
CN-106398219-A Low-hardness damping silicone buffer material and preparation method thereof 昆山市硕鸿电子材料有限公司 2017-02-15 CN disclosed
CN-104388042-B A kind of addition-type silicon rubber composition Guangzhou Huitian Fine Chemical Co., Ltd. (CN) 2016-04-13 CN disclosed
CN-104388042-A Additional type silicone rubber composition GUANGZHOU HUITIAN FINE CHEMICAL CO LTD 2015-03-04 CN disclosed
CN-102165016-B Curable composition and cured product thereof KANEKA CORP 2014-03-12 CN disclosed
CN-101636535-B Substrates having improved ink adhesion and oil crockfastness KIMBERLY CLARK CO 2013-04-17 CN disclosed
CN-101910245-B Process for producing aliphatic polyester MITSUBISHI CHEM CORP 2012-07-18 CN disclosed
CN-102165016-A Curable composition and cured product thereof KANEKA CORP 2011-08-24 CN disclosed
CN-101910245-A Process for producing aliphatic polyester MITSUBISHI CHEM CORP 2010-12-08 CN disclosed
CN-101636535-A Substrates having improved ink adhesion and oil crockfastness KIMBERLY CLARK CO 2010-01-27 CN disclosed
CN-1524104-A Photoreactive composition ��Ԩ��ѧ��ҵ��ʽ���� 2004-08-25 CN disclosed
EP-0402291-B1 Pressure-sensitive adhesive composition H & N CHEMICAL CO (US) 1996-01-31 EP disclosed
US-5214094-A High solids, coatable viscosity; chain transfer solvent in delayed reactant mixture; storage stable H. & N. CHEMICAL COMPANY (US) 1993-05-25 US disclosed
US-5194486-A Pressure sensitive adhesive coating with solvent and alkyl acrylate polymer with crosslinking H & N CHEMICAL COMPANY (US) 1993-03-16 US disclosed
EP-0402291-A1 Pressure-sensitive adhesive composition H & N CHEMICAL COMPANY (US) 1990-12-12 EP disclosed