SCHEMBL7051948

SCHEMBL7051948

OC(CNC1CCCC(c2ccccc2)C1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.60
SLC18A3 Q16572 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
MGAM O43451 2/20 0.42
SI P14410 2/20 0.42
AOC3 Q16853 3/20 0.41

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
SCHEMBL7055707 0.82 KDM4E (0.62) KDM4ESLC18A3SIGMAR1L3MBTL1AOC3
SCHEMBL31269802 0.82 KDM4E (0.62) KDM4EL3MBTL1MGAMSIAOC3
SCHEMBL31270029 0.82 KDM4E (0.62) KDM4EL3MBTL1MGAMSIAOC3
SCHEMBL10877574 0.81 KDM4E (0.88) KDM4EL3MBTL1
SCHEMBL10877567 0.81 KDM4E (0.88) KDM4EL3MBTL1
SCHEMBL31269959 0.80 KDM4E (0.71) KDM4EL3MBTL1MGAMSIAOC3
SCHEMBL7056462 0.79 ADRB3 (0.44) KDM4E
SCHEMBL8076934 0.79 ADRB3 (0.44) KDM4E
SCHEMBL7052344 0.78 ADRB3 (0.43) KDM4E
SCHEMBL13799342 0.78 ADRB3 (0.43) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0940387-B1 PHENYLETHANOLAMINE COMPOUNDS USEFUL AS BETA3 AGONIST, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATES IN THE PRODUCTION OF THE SAME MITSUBISHI PHARMA CORP (JP) 2003-05-07 EP claimed
US-6069176-A PHENYLETHANOLAMINE COMPOUNDS WITH A BETA-3 ADRENERGIC RECEPTOR STIMULATING EFFECT, USE AS A THERAPY FOR URINARY INCONTINENCE MITSUBISHI-TOKYO PHARMACEUTICALS, INC. (JP) 2000-05-30 US claimed
EP-0940387-A1 PHENYLETHANOLAMINE COMPOUNDS USEFUL AS BETA3 AGONIST, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATES IN THE PRODUCTION OF THE SAME TOKYO TANABE COMPANY LIMITED (JP) 1999-09-08 EP claimed
US-7544841-B2 Production method of phenylethanolamine compound, and its intermediate MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-09 US disclosed
US-20070287864-A1 Production Method of Phenylethanolamine Compound, and Its Intermediate MITSUBISHI PHARMA CORPORATION (JP) 2007-12-13 US disclosed
US-6069176-A PHENYLETHANOLAMINE COMPOUNDS WITH A BETA-3 ADRENERGIC RECEPTOR STIMULATING EFFECT, USE AS A THERAPY FOR URINARY INCONTINENCE MITSUBISHI-TOKYO PHARMACEUTICALS, INC. (JP) 2000-05-30 US disclosed
WO-2000000459-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE TRANS-CYCLOHEXYLAMINE COMPOUNDS MITSUBISHI-TOKYO PHARMACEUTICALS, INC. (JP) 2000-01-06 WO disclosed
EP-0940387-A1 PHENYLETHANOLAMINE COMPOUNDS USEFUL AS BETA3 AGONIST, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATES IN THE PRODUCTION OF THE SAME TOKYO TANABE COMPANY LIMITED (JP) 1999-09-08 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-20070287864-A1 Production Method of Phenylethanolamine Compound, and Its Intermediate PNMT, COMT, CYP2E1 KDM4E 4259/4885SLC18A3 280/4885SIGMAR1 65/4885

“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.