SCHEMBL2234289

SCHEMBL2234289

COCCCOC(=O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
RECQL P46063 1/20 0.33
ATM Q13315 1/20 0.32
ACACB O00763 1/20 0.32
NAAA Q02083 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL17453513 0.95 ALDH1A1 (0.46) ALDH1A1TSHRHPGDRECQLNAAA
SCHEMBL20353360 0.93 ALDH1A1 (0.50) ALDH1A1TSHRNAAA
SCHEMBL20353359 0.93 ALDH1A1 (0.50) ALDH1A1TSHRNAAA
SCHEMBL9480850 0.90 ALDH1A1 (0.40) ALDH1A1TSHRHPGDKMT2AATM
SCHEMBL863124 0.85 TSHR (0.43) ALDH1A1TSHRHPGDKMT2ARECQL
SCHEMBL26242404 0.84 ALDH1A1 (0.33) ALDH1A1TSHRKMT2A
SCHEMBL27982814 0.82 NAAA (0.44) ALDH1A1TSHRNAAA
SCHEMBL8421539 0.82 NAAA (0.44) ALDH1A1TSHRNAAA
SCHEMBL23819235 0.82 ALDH1A1 (0.39) ALDH1A1TSHRHPGDKMT2ARECQL
SCHEMBL9936682 0.82 ALDH1A1 (0.39) ALDH1A1TSHRHPGDKMT2ARECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382343-B2 Procatalyst composition with alkoxypropyl ester internal electron donor and polymer from same W. R. GRACE & CO.-CONN. (US) 2016-07-05 US claimed
US-20130289228-A1 Procatalyst Composition with Alkoxypropyl Ester Internal Electron Donor and Polymer from Same W. R. GRACE & CO.-CONN. 2013-10-31 US claimed
EP-2656468-A2 PROCATALYST COMPOSITION WITH ALKOXYPROPYL ESTER INTERNAL ELECTRON DONOR AND POLYMER FROM SAME Dow Global Technologies LLC (US) 2013-10-30 EP claimed
WO-2012087522-A2 PROCATALYST COMPOSITION WITH ALKOXYPROPYL ESTER INTERNAL ELECTRON DONOR AND POLYMER FROM SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2012-06-28 WO claimed
US-20120157645-A1 Procatalyst Composition with Alkoxypropyl Ester Internal Electron Donor and Polymer From Same W.R. GRACE & CO.-CONN. 2012-06-21 US claimed
WO-2023131530-A1 A CLEANING COMPOSITION FOR METAL SUBSTRATES PRETREATMENT AND ITS PREPARATION METHOD AND APPLICATION THEREOF BASF COATINGS GMBH (DE) 2023-07-13 WO disclosed
US-9382343-B2 Procatalyst composition with alkoxypropyl ester internal electron donor and polymer from same W. R. GRACE & CO.-CONN. (US) 2016-07-05 US disclosed
US-9382343-B2 Procatalyst composition with alkoxypropyl ester internal electron donor and polymer from same W. R. GRACE & CO.-CONN. (US) 2016-07-05 US disclosed
US-9382343-B2 Procatalyst composition with alkoxypropyl ester internal electron donor and polymer from same W. R. GRACE & CO.-CONN. (US) 2016-07-05 US disclosed
US-20160024327-A1 DISPERSED COMPOSITION, COATING COMPOSITION, COATING FILM, AND COLORED ITEM TOYO INK HOLDINGS CO., LTD. (JP) 2016-01-28 US disclosed
US-20150315146-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYCLOALKENYLETHYNYL)-BICYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2015-11-05 US disclosed
US-20150315146-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYCLOALKENYLETHYNYL)-BICYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2015-11-05 US disclosed
CN-102176820-A Liquid crop protection formulations containing pyraclostrobin BASF SE 2011-09-07 CN disclosed
CN-102176821-A Liquid aqueous crop protection formulations BASF SE 2011-09-07 CN disclosed
US-20110195846-A1 Liquid Pyraclostrobin-Containing Crop Protection Formulations BASF SE (DE) 2011-08-11 US disclosed
US-20110195839-A1 Liquid Aqueous Crop Protection Formulations BASF SE (DE) 2011-08-11 US disclosed
EP-2348833-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-08-03 EP disclosed
EP-2346322-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-07-27 EP disclosed
WO-2010040835-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO disclosed
WO-2010040834-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO 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 (2 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-20150315146-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYCLOALKENYLETHYNYL)-BICYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS AAK1, SYMPK, CBR1 ALDH1A1 826/4885TSHR 4046/4885HPGD 856/4885
US-20110195839-A1 Liquid Aqueous Crop Protection Formulations AQP1, GANC, BROX ALDH1A1 2866/4885TSHR 4639/4885HPGD 2693/4885

“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.