SCHEMBL7220532

SCHEMBL7220532

Cc1cc(O)ccc1Oc1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.46
ESR1 P03372 1/20 0.42
ALDH1A1 P00352 5/20 0.41
CYP2A6 P11509 1/20 0.41
IDO1 P14902 2/20 0.41
HSD17B10 Q99714 3/20 0.41
PGR P06401 1/20 0.41
GAA P10253 1/20 0.41
PTGS1 P23219 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 4/20 0.40
HPGD P15428 2/20 0.39
MCL1 Q07820 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
DAO P14920 1/20 0.39
ESR2 Q92731 1/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL8375486 0.83 MEN1 (0.47) ESR2
SCHEMBL4365850 0.81 ALDH1A1 (0.58) ESRRAALDH1A1CYP2A6HSD17B10PGR
SCHEMBL11029113 0.81 ESRRA (0.43) ESRRAALDH1A1CYP2A6IDO1HSD17B10
SCHEMBL8936775 0.81 SLC6A2 (0.55) ESRRAALDH1A1CYP2A6KDM4EHPGD
SCHEMBL5032967 0.80 CYP3A4 (0.44) ESR1ESR2
Phenol SCHEMBL15641995 0.77 KDM4E (0.50) ESRRAALDH1A1HSD17B10PGRGAA
SCHEMBL13871447 0.77 CYP1A2 (0.46) ESR1ALDH1A1HSD17B10MCL1ESR2
Ethane SCHEMBL10636467 0.76 HTR1B (0.50) ESRRAALDH1A1CYP2A6HSD17B10PGR
SCHEMBL442767 0.76 HTR1B (0.54) ESRRAALDH1A1CYP2A6HSD17B10PGR
SCHEMBL29577853 0.76 HTR1B (0.54) ESRRAALDH1A1CYP2A6HSD17B10PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6573278-B2 For therapy and prophylaxis of cerebral apoplexy and craniocerebral trauma BAYER AKTIENGESELLSCHAFT (DE) 2003-06-03 US disclosed
EP-0966436-B1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES BAYER AG (DE) 2002-12-11 EP disclosed
US-20020072529-A1 Arylsulfonamides and analogues BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-06-13 US disclosed
US-6262112-B1 1-(4,4,4-TRIFLUOROBUTYLSULPHONYLOXY)-3-(2-(HYDROXYMETHYL)INDAN -4-YLOXY)-BENZENE BAYER AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed
EP-0966436-A1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Bayer Aktiengesellschaft (DE) 1999-12-29 EP disclosed
WO-1998037061-A1 ARYL SULFONAMIDES AND ANALOGUES THEREOF AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES BAYER AKTIENGESELLSCHAFT (DE) 1998-08-27 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 (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-20020072529-A1 Arylsulfonamides and analogues ARSA, PRSS12, SNCA ESRRA 3684/4885ESR1 4319/4885ALDH1A1 3020/4885

“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.