SCHEMBL4631947

SCHEMBL4631947

COc1ccc(/C=C/C(O)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.59
CYP3A4 P08684 3/20 0.55
ALDH1A1 P00352 3/20 0.55
MAPT P10636 2/20 0.55
CYP2C9 P11712 1/20 0.55
ALOX15 P16050 1/20 0.55
CYP2C19 P33261 1/20 0.55
RELA Q04206 4/20 0.50
BCHE P06276 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
NFE2L2 Q16236 2/20 0.49
THRB P10828 1/20 0.49
ATM Q13315 1/20 0.49
LMNA P02545 2/20 0.47
KDM4E B2RXH2 2/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
TRPM8 Q7Z2W7 2/20 0.47
CYP1B1 Q16678 3/20 0.46

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
SCHEMBL4631951 1.00 TRPA1 (0.59) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL4632481 0.93 TRPA1 (0.59) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL4632483 0.93 TRPA1 (0.59) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL14839505 0.91 ALDH1A1 (0.60) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL16468552 0.86 TRPA1 (0.51) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL10411854 0.86 CYP1A2 (0.52) CYP3A4CYP2C9CYP2C19NFE2L2LMNA
SCHEMBL14839484 0.85 ALDH1A1 (0.54) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL14839479 0.85 ALDH1A1 (0.54) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL477469 0.82 CYP1A2 (0.57) TRPA1CYP3A4ALDH1A1MAPTCYP2C9
SCHEMBL477467 0.82 CYP1A2 (0.57) TRPA1CYP3A4ALDH1A1MAPTCYP2C9

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-110922427-B Process for preparing substituted diphosphonites with bulky steric hindrance 温州大学 2022-07-15 CN disclosed
CN-110922427-A Process for preparing diester of large steric hindrance alkyl substituted phosphonite 温州大学 2020-03-27 CN disclosed
EP-2775996-B1 USE OF PROPANOL AND PROPENOL DERIVATIVES AS ANTIOXIDANTS MERCK PATENT GMBH (DE) 2018-02-28 EP disclosed
US-20150051295-A1 USE OF PROPANOL AND PROPENOL DERIVATIVES AS ANTIOXIDANTS MERCK PATENT GMBH (DE) 2015-02-19 US disclosed
US-20150051295-A1 USE OF PROPANOL AND PROPENOL DERIVATIVES AS ANTIOXIDANTS MERCK PATENT GMBH (DE) 2015-02-19 US disclosed
EP-1927889-B1 Lithographic printing plate precursor FUJIFILM CORP (JP) 2014-06-25 EP disclosed
WO-2013045098-A2 USE OF PROPANOL AND PROPENOL DERIVATIVES AS ANTIOXIDANTS MERCK PATENT GMBH (DE) 2013-04-04 WO disclosed
EP-1927889-A1 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-06-04 EP disclosed
EP-1091253-B1 Plate making process for planographic plate, automatic developing apparatus and recording medium FUJI PHOTO FILM CO LTD (JP) 2005-03-30 EP disclosed
US-6558873-B1 Interlayer containing a compound capable of forming a complex with aluminum and a photopolymerizable photosensitive layer containing a photopolymerization initiator, an addition polymerizable compound capable of complexing with aluminum FUJI PHOTO FILM CO., LTD. (JP) 2003-05-06 US disclosed
EP-1091253-A2 Plate making process for planographic plate, automatic developing apparatus and recording medium FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
EP-1091251-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
US-4687727-A Light-sensitive planographic printing plate with layer of diazo resin containing photopolymerizable composition FUJI PHOTO FILM CO., LTD. (JP) 1987-08-18 US disclosed
US-4511645-A ALLYL METHACRYLATE-METHACRYLIC ACID COPOLYMER, CURING AGENT, PHOTOINITIATOR FUJI PHOTO FILM CO., LTD. (JP) 1985-04-16 US disclosed
EP-0104863-A2 Light-sensitive planographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 1984-04-04 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 (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-20150051295-A1 USE OF PROPANOL AND PROPENOL DERIVATIVES AS ANTIOXIDANTS GPX4, EBP, CAT TRPA1 2582/4885CYP3A4 233/4885ALDH1A1 134/4885

“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.