SCHEMBL42086

SCHEMBL42086

C=CC(=O)OCCCCOP(=O)(OCCCCOC(=O)C=C)OCCCCOC(=O)C=C

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.69
ALDH1A1 P00352 5/20 0.69
CYP3A4 P08684 3/20 0.69
HPGD P15428 1/20 0.57
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
HSD17B10 Q99714 1/20 0.52
LPAR3 Q9UBY5 4/20 0.40
LPAR2 Q9HBW0 2/20 0.40
THRB P10828 2/20 0.40
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.36
HCAR2 Q8TDS4 3/20 0.35
LPAR1 Q92633 2/20 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
SCHEMBL43197 0.96 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL24549756 0.93 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL24604204 0.89 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL24604202 0.88 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL40904 0.88 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL7554442 0.86 TSHR (0.67) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL42087 0.86 TSHR (0.67) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28886859 0.86 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL17923965 0.86 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10321826 0.85 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021116678-A1 IMPROVEMENTS IN, OR RELATING TO, BINDERS AND/OR COATINGS SYNTHOMER (UK) LIMITED (GB) 2021-06-17 WO disclosed
US-10711073-B2 Method of making a branched polymer, a branched polymer and uses of such a polymer SYNTHOMER (UK) LIMITED (GB) 2020-07-14 US disclosed
US-10584263-B2 Aqueous polymer-silicon oil hybrid composition BASF SE (DE) 2020-03-10 US disclosed
EP-3434698-A1 METHOD OF MAKING A BRANCHED POLYMER, A BRANCHED POLYMER AND USES OF SUCH A POLYMER Synthomer (UK) Ltd. (GB) 2019-01-30 EP disclosed
EP-3119815-B1 METHOD OF MAKING A BRANCHED POLYMER, A BRANCHED POLYMER AND USES OF SUCH A POLYMER SYNTHOMER UK LTD (GB) 2018-06-20 EP disclosed
US-20170247570-A1 AQUEOUS POLYMER-SILICON OIL HYBRID COMPOSITION BASF SE (DE) 2017-08-31 US disclosed
EP-3197923-A1 AQUEOUS POLYMER-SILICON OIL HYBRID COMPOSITION BASF SE (DE) 2017-08-02 EP disclosed
US-20170137542-A1 METHOD OF MAKING A BRANCHED POLYMER, A BRANCHED POLYMER AND USES OF SUCH A POLYMER SYNTHOMER (UK) LIMITED (GB) 2017-05-18 US disclosed
US-9587083-B2 Process for producing polymer-shell nanoparticles BASF SE (DE) 2017-03-07 US disclosed
EP-3119815-A1 METHOD OF MAKING A BRANCHED POLYMER, A BRANCHED POLYMER AND USES OF SUCH A POLYMER Synthomer (UK) Ltd. (GB) 2017-01-25 EP disclosed
US-20140243450-A1 PROCESS FOR PRODUCING POLYMER-SHELL NANOPARTICLES BASF SE (DE) 2014-08-28 US disclosed
US-20140061026-A1 Finely divided particles of core-shell structure KARLSRUHER INSTITUT FUER TECHNOLOGIE (KIT) (DE) 2014-03-06 US disclosed
EP-2582243-A2 AQUEOUS ACTIVE INGREDIENT COMPOSITION BASF SE (DE) 2013-04-24 EP disclosed
US-20130078297-A1 Aqueous Active Ingredient Composition BASF SE (DE) 2013-03-28 US disclosed
EP-2493581-A2 COMPOSITION SUITABLE FOR PRODUCTION OF FOAM EXTINGUISHANTS FLN Feuerlöschgeräte Neuruppin Vertriebs GmbH (DE) 2012-09-05 EP disclosed
WO-2012113896-A1 PROCESS FOR THE PREPARATION OF AN AQUEOUS POLYMER LATEX BASF SE (DE) 2012-08-30 WO disclosed
WO-2011157725-A2 AQUEOUS ACTIVE INGREDIENT COMPOSITION BASF SE (DE) 2011-12-22 WO disclosed
US-20110240309-A1 COMPOSITION SUITABLE FOR PRODUCTION OF FOAM EXTINGUISHANTS KINGMA AREND JOUKE 2011-10-06 US disclosed
WO-2011050980-A2 COMPOSITION SUITABLE FOR PRODUCTION OF FOAM EXTINGUISHANTS FLN FEUERLöSCHGERäTE NEURUPPIN VERTRIEBS GMBH (DE) 2011-05-05 WO disclosed
US-4576793-A MULTILAYER, POROSITY, SPREADING, UNSATURATED ACID COPOLYMEWR KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1986-03-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130078297-A1 Aqueous Active Ingredient Composition H1-0, H1-2, PLA2G2C TSHR 4764/4885ALDH1A1 1439/4885CYP3A4 2690/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.