SCHEMBL9736825

SCHEMBL9736825

COC(C)OC(=O)Cc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.71
ALDH1A1 P00352 3/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KLK7 P49862 7/20 0.49
PAM P19021 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
AKR1B1 P15121 1/20 0.45
CYP19A1 P11511 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
FAAH O00519 1/20 0.44

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
SCHEMBL873430 0.83 TSHR (1.00) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL28389293 0.83 TSHR (0.67) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL11327414 0.83 TSHR (0.67) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL23611413 0.81 TSHR (0.55) TSHRALDH1A1MAPK1L3MBTL1PAM
Hydrochloric Acid SCHEMBL27332250 0.81 TSHR (0.96) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL27120274 0.81 TSHR (0.76) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL28134676 0.81 TSHR (0.76) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL27883126 0.81 TSHR (0.96) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL8847851 0.81 TSHR (0.65) TSHRALDH1A1MAPK1L3MBTL1KLK7
SCHEMBL13333910 0.81 TSHR (0.65) TSHRALDH1A1MAPK1L3MBTL1KLK7

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778442-A Olefin polymerization catalyst solid component, preparation method thereof, olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-11 CN claimed
CN-112759683-A Olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-07 CN claimed
CN-116135892-B Method for preparing bimodal polyethylene resin for pipe material and bimodal polyethylene resin thereof 中国石油化工股份有限公司 2024-10-15 CN disclosed
CN-116135892-A Method for preparing bimodal polyethylene resin for pipe material and bimodal polyethylene resin thereof 中国石油化工股份有限公司 2023-05-19 CN disclosed
CN-111057169-B Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2023-02-28 CN disclosed
CN-112778442-A Olefin polymerization catalyst solid component, preparation method thereof, olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-11 CN disclosed
CN-112759683-A Olefin polymerization catalyst and application 中国石油化工股份有限公司 2021-05-07 CN disclosed
CN-111057168-A Catalyst for olefin polymerization and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 CN disclosed
CN-103772536-B A kind of catalytic component for vinyl polymerization or combined polymerization and catalyst thereof SINOPEC CORP. (CN) 2016-05-25 CN disclosed
US-8946144-B2 Phosphonated glycopeptide and lipoglycopeptide antibiotics and uses thereof for the prevention and treatment of bone and joint infections THE MEDICINES COMPANY (US) 2015-02-03 US disclosed
US-8901072-B2 Glycopeptide and lipoglycopeptide antibiotics with improved solubility THE MEDICINES COMPANY (US) 2014-12-02 US disclosed
US-20120149632-A1 GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS WITH IMPROVED SOLUBILITY THE MEDICINES COMPANY (US) 2012-06-14 US disclosed
US-20100113333-A1 PHOSPHONATED GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS TARGANTA THERAPEUTICS, INC. (CA) 2010-05-06 US disclosed
US-5107034-A Bromination of 4-hydroxyacetophenone, treating with methoxide to produce alpha-methoxy-4-hydroxyacetophenone, reduction HOECHST CELANESE CORPORATION (US) 1992-04-21 US disclosed
EP-0449602-A1 Method for producing 4-(2'-methoxyethyl) phenol HOECHST CELANESE CORPORATION (US) 1991-10-02 EP 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-20100113333-A1 PHOSPHONATED GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS PGLS, BPGM, PAG1 TSHR 4348/4885ALDH1A1 4184/4885MAPK1 1463/4885
US-20120149632-A1 GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS WITH IMPROVED SOLUBILITY NGLY1, LGALS3BP, GYPA TSHR 3204/4885ALDH1A1 4197/4885MAPK1 3513/4885

“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.