SCHEMBL3944934

SCHEMBL3944934

C=CCCC1=C(CCCC)CC1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
ALDH1A1 P00352 1/20 0.48
THRA P10827 1/20 0.31
THRB P10828 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
SCHEMBL2019543 0.88 TSHR (0.58) TSHRALDH1A1
SCHEMBL7459385 0.83 TSHR (0.64) TSHRALDH1A1THRATHRB
SCHEMBL18983083 0.78 TSHR (0.42) TSHRALDH1A1
SCHEMBL2016082 0.75 TSHR (0.46) TSHRALDH1A1
SCHEMBL9257780 0.74 TSHR (0.35) TSHRALDH1A1
SCHEMBL2335039 0.73 SCD (0.46) TSHRALDH1A1THRB
SCHEMBL4452153 0.71 MEN1 (0.36) TSHRALDH1A1THRB
SCHEMBL9340336 0.71 SCD (0.50) TSHRALDH1A1THRB
SCHEMBL4636535 0.70 THRB (0.55) TSHRALDH1A1THRATHRB
SCHEMBL12802457 0.70 TSHR (0.48) TSHRALDH1A1THRATHRB

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
CN-106661159-B Ethylene -1- hexene -1- butene terpolymers and the film comprising the terpolymer LG化学株式会社 2019-08-27 CN claimed
WO-2024013378-A1 MULTILAYER UNIAXIALLY ORIENTED FILM REPSOL, S.A. (ES) 2024-01-18 WO disclosed
EP-3288761-B1 HIGH OPTICS MACHINE DIRECTION ORIENTED LABEL FACESTOCK AVERY DENNISON CORP (US) 2021-06-30 EP disclosed
CN-107635766-B Machine direction oriented label facestock with high optical properties 艾利丹尼森公司 2020-08-14 CN disclosed
CN-106661159-B Ethylene -1- hexene -1- butene terpolymers and the film comprising the terpolymer LG化学株式会社 2019-08-27 CN disclosed
CN-106661159-B Ethylene -1- hexene -1- butene terpolymers and the film comprising the terpolymer LG化学株式会社 2019-08-27 CN disclosed
US-10155364-B2 High optics machine direction oriented label facestock AVERY DENNISON CORPORATION (US) 2018-12-18 US disclosed
US-9919300-B2 1-hexene production process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-20 US disclosed
EP-2484685-B1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-11-01 EP disclosed
US-20170226383-A1 Conformable and Die-Cuttable Machine Direction Oriented Labelstocks and Labels, and Process for Preparing AVERY DENNISON CORP (US) 2017-08-10 US disclosed
US-20160318288-A1 High Optics Machine Direction Oriented Label Facestock AVERY DENNISON CORPORATION 2016-11-03 US disclosed
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
US-20150105572-A1 TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
EP-2049333-B1 CONFORMABLE AND DIE-CUTTABLE MACHINE DIRECTION ORIENTED LABELSTOCKS AND LABELS, AND PROCESS FOR PREPARING AVERY DENNISON CORP (US) 2012-12-05 EP disclosed
EP-2484685-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND Sumitomo Chemical Co., Ltd (JP) 2012-08-08 EP disclosed
US-20120184431-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed
US-20120184693-A1 ETHYLENE POLYMER PREPARATION METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed
US-20090130360-A1 CONFORMABLE AND DIE-CUTTABLE MACHINE DIRECTION ORIENTED LABELSTOCKS AND LABELS, AND PROCESS FOR PREPARING AVERY DENNISON CORPORATION 2009-05-21 US disclosed
EP-2049333-A1 CONFORMABLE AND DIE-CUTTABLE MACHINE DIRECTION ORIENTED LABELSTOCKS AND LABELS, AND PROCESS FOR PREPARING Avery Dennison Corporation (US) 2009-04-22 EP disclosed
WO-2007146986-A1 CONFORMABLE AND DIE-CUTTABLE MACHINE DIRECTION ORIENTED LABELSTOCKS AND LABELS, AND PROCESS FOR PREPARING AVERY DENNISON CORPORATION (US) 2007-12-21 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 (3 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-20150105572-A1 TRANSITION METAL COMPLEX AP1M1, AP3M1, EMC1 TSHR 1786/4885ALDH1A1 2292/4885THRA 1843/4885
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST AP1M1, AMY1A, AP3M1 TSHR 3015/4885ALDH1A1 2399/4885THRA 3085/4885
US-20120184431-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND EMC1, CYC1, AP1M1 TSHR 2248/4885ALDH1A1 2139/4885THRA 3137/4885

“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.