SCHEMBL206693

SCHEMBL206693

CCCCOC(COC(=O)c1ccccc1C(=O)OCC(OCCCC)(OCCCC)OCCCC)(OCCCC)OCCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.68
TDP1 Q9NUW8 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
CYP3A4 P08684 4/20 0.61
MAPK1 P28482 2/20 0.61
TP53 P04637 1/20 0.61
ALDH1A1 P00352 8/20 0.59
LMNA P02545 2/20 0.59
HSD17B10 Q99714 2/20 0.55
KDM4E B2RXH2 2/20 0.49
CA2 P00918 1/20 0.49
POLB P06746 1/20 0.49
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.44
CYP2C9 P11712 1/20 0.43

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
SCHEMBL206692 0.94 TSHR (0.60) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL9317946 0.86 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
Dibutyl Phthalate SCHEMBL24051 0.81 TSHR (1.00) TSHRTDP1L3MBTL1CYP3A4MAPK1
Dibutyl Phthalate SCHEMBL29353340 0.81 TSHR (1.00) TSHRTDP1L3MBTL1CYP3A4MAPK1
Dibutyl Phthalate SCHEMBL4596231 0.81 TSHR (1.00) TSHRTDP1L3MBTL1CYP3A4MAPK1
Dibutyl Phthalate SCHEMBL2330224 0.81 TSHR (1.00) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL7062431 0.81 TSHR (0.78) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL206691 0.81 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL6562255 0.80 TSHR (0.57) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL10536144 0.80 LMNA (0.56) TSHRTDP1CYP3A4MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057241-B1 TEREPHTHALATES AS PLASTICIZERS IN VINYL ACETATE POLYMER COMPOSITIONS EASTMAN CHEM CO (US) 2012-08-01 EP claimed
US-8088854-B2 Stable aqueous emulsions; lower glass transition and film forming temperatures; higher viscosity; adhesives, coatings EASTMAN CHEMICAL COMPANY (US) 2012-01-03 US claimed
EP-2377905-A1 Terephthalates as plasticizers in vinyl acetate polymer compositions EASTMAN CHEMICAL COMPANY (US) 2011-10-19 EP claimed
EP-2057241-A1 TEREPHTHALATES AS PLASTICIZERS IN VINYL ACETATE POLYMER COMPOSITIONS Eastman Chemical Company (US) 2009-05-13 EP claimed
US-20080058450-A1 TEREPHTHALATES AS PLASTICIZERS IN VINYL ACETATE POLYMER COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2008-03-06 US claimed
WO-2008027435-A1 TEREPHTHALATES AS PLASTICIZERS IN VINYL ACETATE POLYMER COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2008-03-06 WO claimed
US-5545472-A Water-borne, water redispersible, laminating adhesives for nonwoven applications NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1996-08-13 US claimed
US-5532300-A Water-borne, water redispersible, laminating adhesives for nonwoven applications NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1996-07-02 US claimed
US-5442001-A Vinyl acetate or acrylic polymer dispersion in solvent of alkyl butyrate, limonene, ethylene glycol monobutyl ether, petroleum distillates or normal paraffins NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1995-08-15 US claimed
US-5100944-A For packaging, nontoxic, nonpolluting NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-03-31 US claimed
US-20250082451-A1 METHODS OF MAKING AN ORAL APPLIANCE Emanate Biomedical, Inc. (US) 2025-03-13 US disclosed
US-12156773-B2 Methods of making an oral appliance Emanate Biomedical, Inc. (US) 2024-12-03 US disclosed
US-20240307164-A1 ORAL APPLIANCE IN A BLOCKCHAIN SYSTEM Emanate Biomedical, Inc. (US) 2024-09-19 US disclosed
US-11986368-B2 Oral appliance in a blockchain system Emanate Biomedical, Inc. (US) 2024-05-21 US disclosed
US-20230037613-A1 METHODS OF MAKING AN ORAL APPLIANCE Emanate Blomedical, inc. (US) 2023-02-09 US disclosed
US-5519072-A LATEX, DEXTRIN NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1996-05-21 US disclosed
EP-0687719-A1 High performance PVOH stabilized EVA adhesives National Starch and Chemical Investment Holding Corporation (US) 1995-12-20 EP disclosed
US-5442001-A Vinyl acetate or acrylic polymer dispersion in solvent of alkyl butyrate, limonene, ethylene glycol monobutyl ether, petroleum distillates or normal paraffins NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1995-08-15 US disclosed
EP-0643115-A2 Use of low toxicity solvents in waterborne adhesives National Starch and Chemical Investment Holding Corporation (US) 1995-03-15 EP disclosed
US-5100944-A For packaging, nontoxic, nonpolluting NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-03-31 US disclosed