SCHEMBL13799337

SCHEMBL13799337

CCOC(=O)COc1cccc(C2CCCC(NCC(O)c3cccc(Cl)c3)C2)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 9/20 0.67
ADRB1 P08588 3/20 0.49
GLA P06280 1/20 0.43
ADRB2 P07550 1/20 0.43
BCHE P06276 1/20 0.43

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
SCHEMBL8076585 1.00 ADRB3 (0.67) ADRB3ADRB1GLAADRB2BCHE
SCHEMBL4071036 1.00 ADRB3 (0.67) ADRB3ADRB1GLAADRB2BCHE
SCHEMBL7057571 1.00 ADRB3 (0.67) ADRB3ADRB1GLAADRB2BCHE
SCHEMBL4071040 1.00 ADRB3 (0.67) ADRB3ADRB1GLAADRB2BCHE
SCHEMBL7053502 1.00 ADRB3 (0.67) ADRB3ADRB1GLAADRB2BCHE
Hydrochloric Acid SCHEMBL7053904 0.99 ADRB3 (0.66) ADRB3ADRB1GLAADRB2BCHE
Maleic Acid SCHEMBL4071458 0.95 ADRB3 (0.62) ADRB3ADRB1
Fumaric Acid SCHEMBL4071460 0.95 ADRB3 (0.62) ADRB3ADRB1
SCHEMBL7058076 0.93 ADRB3 (0.68) ADRB3ADRB1GLAADRB2
SCHEMBL8073362 0.93 ADRB3 (0.68) ADRB3ADRB1GLAADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544841-B2 Production method of phenylethanolamine compound, and its intermediate MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-09 US disclosed
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-20070287864-A1 Production Method of Phenylethanolamine Compound, and Its Intermediate MITSUBISHI PHARMA CORPORATION (JP) 2007-12-13 US 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 ADRB3 4/4885ADRB1 7/4885GLA 3159/4885

“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.