SCHEMBL9234580

SCHEMBL9234580

COc1ccc(COCC2CO2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.51
IDO1 P14902 3/20 0.47
AGXT P21549 2/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TRPV6 Q9H1D0 1/20 0.43
DRD4 P21917 1/20 0.43
TP53 P04637 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PPARG P37231 1/20 0.42
HIF1A Q16665 1/20 0.42
APP P05067 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL9618007 1.00 PKM (0.51) PKMIDO1AGXTCA1CA2
1,4-Dimethoxybenzene SCHEMBL11135429 0.87 PKM (0.58) PKMCA1CA2DRD4TP53
SCHEMBL731016 0.87 TSHR (0.48) TP53MAPTHPGDTSHRMEN1
SCHEMBL732255 0.84 TDP1 (0.59) PKMDRD4TP53MAPTHPGD
SCHEMBL18548800 0.84 TDP1 (0.59) PKMDRD4TP53MAPTHPGD
SCHEMBL5854038 0.83 TDP1 (0.47) PKMIDO1AGXTCA1CA2
Glycidol SCHEMBL19463580 0.83 CA1 (0.45) PKMIDO1AGXTCA1CA2
SCHEMBL7238655 0.83 PKM (0.49) PKMDRD4TP53MAPTHPGD
SCHEMBL16614412 0.83 TDP1 (0.47) PKMIDO1AGXTCA1CA2
Mequinol SCHEMBL3679208 0.83 PKM (0.51) PKMTP53MAPTHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708491-A Polydisulfide polymer material containing hydroxy ester group and preparation method thereof 衢州化工新材料创新研究院 2025-03-28 CN claimed
CN-119708491-A Polydisulfide polymer material containing hydroxy ester group and preparation method thereof 衢州化工新材料创新研究院 2025-03-28 CN disclosed
CN-116037208-A Preparation method of simple-synthesized high-stability silver cluster-based metal-organic framework 山东理工大学 2023-05-02 CN disclosed
CN-108779082-B Contrast agents 伯拉考成像股份公司 2022-08-02 CN disclosed
EP-3442949-B1 CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2022-06-08 EP disclosed
US-11007283-B2 Contrast agents BRACCO IMAGING S.P.A. (IT) 2021-05-18 US disclosed
CN-111263783-A Polymeric dispersants from phenyl glycidyl ethers 斯泰潘公司 2020-06-09 CN disclosed
US-20190167819-A1 CONTRAST AGENTS BRACCO IMAGING S.P.A. (IT) 2019-06-06 US disclosed
EP-3442949-A1 CONTRAST AGENTS Bracco Imaging S.p.A (IT) 2019-02-20 EP disclosed
CN-108779082-A CONTRAST AGENTS 伯拉考成像股份公司 2018-11-09 CN disclosed
WO-2017178301-A1 CONTRAST AGENTS BRACCO IMAGING SPA (IT) 2017-10-19 WO disclosed
EP-2935278-B1 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL NOVARTIS AG (CH) 2017-03-15 EP disclosed
US-9359381-B2 Tricyclic compounds for inhibiting the CFTR channel NOVARTIS AG (CH) 2016-06-07 US disclosed
US-20150336986-A1 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL NOVARTIS AG (CH) 2015-11-26 US disclosed
EP-2935278-A1 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL Novartis AG (CH) 2015-10-28 EP disclosed
WO-2014097148-A9 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL NOVARTIS AG (CH) 2015-02-19 WO disclosed
WO-2014097148-A1 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL NOVARTIS AG (CH) 2014-06-26 WO disclosed
US-20140171417-A1 TRICYCLIC COMPOUNDS NOVARTIS AG (CH) 2014-06-19 US disclosed
EP-0664316-A1 Polycarbonate composition having improved resistance to gamma-ray radiation TEIJIN LIMITED (JP) 1995-07-26 EP disclosed
EP-0264114-A1 Alpha-[(phenylmethoxy)methyl]pyridine-alkanol derivatives G.D. Searle & Co. (US) 1988-04-20 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 (4 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-20150336986-A1 TRICYCLIC COMPOUNDS FOR INHIBITING THE CFTR CHANNEL CFTR, SLC26A4, ABCB11 PKM 2989/4885IDO1 4562/4885AGXT 2017/4885
US-11007283-B2 Contrast agents PHOSPHO1, ITPA, PPIP5K2 PKM 2503/4885IDO1 3324/4885AGXT 3729/4885
US-20140171417-A1 TRICYCLIC COMPOUNDS SLC10A1, CYP11B2, CYP11B1 PKM 824/4885IDO1 2838/4885AGXT 1099/4885
US-20190167819-A1 CONTRAST AGENTS PHOSPHO1, ITPA, PPIP5K2 PKM 2503/4885IDO1 3324/4885AGXT 3729/4885

“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.