SCHEMBL5541737

SCHEMBL5541737

OC1=CCOc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.37
ITGB2 P05107 1/20 0.37
ICAM1 P05362 1/20 0.37
ITGAL P20701 1/20 0.37
MAOB P27338 5/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
MIF P14174 1/20 0.36
ACHE P22303 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 3/20 0.35
HSD17B10 Q99714 2/20 0.35
ALPL P05186 1/20 0.35
CYP19A1 P11511 1/20 0.34
LMNA P02545 3/20 0.33

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
SCHEMBL30218838 1.00 PKM (0.42) PKMTSHRABCG2ITGB2ICAM1
Hydrochloric Acid SCHEMBL7284611 0.98 PKM (0.41) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL9382531 0.79 ITGB2 (0.44) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL2676035 0.77 MAOA (0.50) MAOBMIFALDH1A1KDM4ECYP19A1
SCHEMBL7039789 0.74 PKM (0.42) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL294469 0.74 TSHR (0.42) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL276292 0.74 PKM (0.47) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL29474944 0.74 PKM (0.42) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL11845341 0.74 PKM (0.42) PKMTSHRABCG2ITGB2ICAM1
SCHEMBL294470 0.74 PKM (0.42) PKMTSHRABCG2ITGB2ICAM1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4647579-A Circulation active novel substituted 4-hydroxy-benzopyrans BAYER AKTIENGESELLSCHAFT (DE) 1987-03-03 US claimed
EP-0158164-A2 Substituted 4-hydroxy-benzopyrans, process for their preparation and their use in medicines BAYER AG (DE) 1985-10-16 EP claimed
CN-115974854-A Phenolenyl phthalide pyrazolones compound and preparation method and application thereof 四川大学 2023-04-18 CN disclosed
WO-2023023670-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ, INC. (US) 2023-02-23 WO disclosed
US-11141402-B2 Compounds useful in inhibiting human trefoil factor 3 NATIONAL UNIVERSITY OF SINGAPORE (SG) 2021-10-12 US disclosed
EP-3672954-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES Acadia Pharmaceuticals Inc. (US) 2020-07-01 EP disclosed
US-20200147039-A1 COMPOUNDS USEFUL IN INHIBITING HUMAN TREFOIL FACTOR 3 NATIONAL UNIVERSITY OF SINGAPORE (SG) 2020-05-14 US disclosed
WO-2019040107-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2019-02-28 WO disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
US-5521147-A HERBICIDES FMC CORPORATION (US) 1996-05-28 US disclosed
US-4647579-A Circulation active novel substituted 4-hydroxy-benzopyrans BAYER AKTIENGESELLSCHAFT (DE) 1987-03-03 US disclosed
US-4647579-A Circulation active novel substituted 4-hydroxy-benzopyrans BAYER AKTIENGESELLSCHAFT (DE) 1987-03-03 US disclosed
US-4647579-A Circulation active novel substituted 4-hydroxy-benzopyrans BAYER AKTIENGESELLSCHAFT (DE) 1987-03-03 US disclosed
EP-0158164-A3 SUBSTITUTED 4-HYDROXY-BENZOPYRANS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN MEDICINES BAYER AG (DE) 1986-09-03 EP disclosed
EP-0158164-A2 Substituted 4-hydroxy-benzopyrans, process for their preparation and their use in medicines BAYER AG (DE) 1985-10-16 EP disclosed
EP-0158164-A2 Substituted 4-hydroxy-benzopyrans, process for their preparation and their use in medicines BAYER AG (DE) 1985-10-16 EP disclosed
EP-0158164-A2 Substituted 4-hydroxy-benzopyrans, process for their preparation and their use in medicines BAYER AG (DE) 1985-10-16 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-11141402-B2 Compounds useful in inhibiting human trefoil factor 3 ETF1, F3, DNASE1L3 PKM 4471/4885TSHR 459/4885ABCG2 1953/4885
US-20200147039-A1 COMPOUNDS USEFUL IN INHIBITING HUMAN TREFOIL FACTOR 3 ETF1, F3, DNASE1L3 PKM 4471/4885TSHR 459/4885ABCG2 1953/4885

“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.