SCHEMBL382008

SCHEMBL382008

OCCCC1CCC(O)CC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.34
SLC18A3 Q16572 1/20 0.32
ESR2 Q92731 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
SHBG P04278 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL29669639 1.00 CNR2 (0.34) CNR2SLC18A3ESR2CYP1A2TSHR
SCHEMBL4814734 0.92 SIGMAR1 (0.33) CNR2SLC18A3ESR2CYP1A2TSHR
SCHEMBL1543625 0.89 CYP1A2 (0.38) SLC18A3ESR2CYP1A2TSHRLMNA
SCHEMBL79852 0.89
SCHEMBL796462 0.86 SLC18A3 (0.40) SLC18A3CYP1A2TSHRLMNAMAPK1
SCHEMBL7068277 0.86 SIGMAR1 (0.39) SLC18A3CYP1A2TSHRLMNAMAPK1
SCHEMBL25025914 0.83 ESR2 (0.43) ESR2TSHRSHBG
SCHEMBL18421585 0.83 ESR2 (0.43) SLC18A3ESR2CYP1A2LMNAMAPK1
SCHEMBL103167 0.83 ESR2 (0.43) ESR2TSHRSHBG
SCHEMBL18421980 0.83 SIGMAR1 (0.37) ESR2CYP1A2TSHRLMNAMAPK1

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-2009110971-A2 PROCESS FOR CONVERTING MULTIFUNCTIONAL ALIPHATIC ALCOHOLS DENDRITIC NANOTECHNOLOGIES, INC. (US) 2009-09-11 WO claimed
US-10723876-B2 Thermoplastic resin composition and molded article comprising the same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2020-07-28 US disclosed
US-10364348-B2 Thermoplastic resin composition and molded article comprising the same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2019-07-30 US disclosed
EP-3135728-B1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME LOTTE ADVANCED MAT CO LTD (KR) 2018-03-07 EP disclosed
US-20170058122-A1 Thermoplastic Resin Composition and Molded Article Comprising the Same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2017-03-02 US disclosed
US-20170058121-A1 Thermoplastic Resin Composition and Molded Article Comprising the Same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2017-03-02 US disclosed
EP-3135728-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME Lotte Advanced Materials Co., Ltd. (KR) 2017-03-01 EP disclosed
US-20170029617-A1 Thermoplastic Resin Composition and Molded Article Comprising the Same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2017-02-02 US disclosed
US-9522864-B2 Process for direct conversion of biomass to liquid fuels and chemicals THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-12-20 US disclosed
US-9522864-B2 Process for direct conversion of biomass to liquid fuels and chemicals THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-12-20 US disclosed
US-8796494-B2 Process for direct conversion of biomass to liquid fuels and chemicals THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-08-05 US disclosed
US-8796494-B2 Process for direct conversion of biomass to liquid fuels and chemicals THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-08-05 US disclosed
US-8772226-B2 Methods and compositions for the detection of cancer THE JOHNS HOPKINS UNIVERSITY (US) 2014-07-08 US disclosed
EP-2049522-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2014-05-14 EP disclosed
US-20120093724-A1 METHODS AND COMPOSITIONS FOR THE DETECTION OF CANCER THE JOHNS HOPKINS UNIVERSITY (US) 2012-04-19 US disclosed
EP-2408465-A2 METHODS AND COMPOSITIONS FOR THE DETECTION OF CANCER The Johns Hopkins University (US) 2012-01-25 EP disclosed
US-20110065814-A1 PROCESS FOR DIRECT CONVERSION OF BIOMASS TO LIQUID FUELS AND CHEMICALS NATIONAL SCIENCE FOUNDATION 2011-03-17 US disclosed
US-20110065814-A1 PROCESS FOR DIRECT CONVERSION OF BIOMASS TO LIQUID FUELS AND CHEMICALS NATIONAL SCIENCE FOUNDATION 2011-03-17 US disclosed
WO-2010107909-A2 METHODS AND COMPOSITIONS FOR THE DETECTION OF CANCER THE JOHNS HOPKINS UNIVERSITY (US) 2010-09-23 WO disclosed
WO-2009158499-A2 PREVENTION OF BACTERIAL GROWTH AND BIOFILM FORMATION BY LIGANDS THAT ACT ON CANNABINOIDERGIC SYSTEMS UNIVERSITY OF NORTH TEXAS HEALTH SCIENCE CENTER AT FORT WORTH (US) 2009-12-30 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-20120093724-A1 METHODS AND COMPOSITIONS FOR THE DETECTION OF CANCER KLK3, KLK2, KLK5 CNR2 850/4885SLC18A3 3678/4885ESR2 515/4885
US-20110065814-A1 PROCESS FOR DIRECT CONVERSION OF BIOMASS TO LIQUID FUELS AND CHEMICALS C9, C5, ADH1C CNR2 500/4885SLC18A3 3311/4885ESR2 3205/4885

“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.