SCHEMBL4638683

SCHEMBL4638683

O=C(OCc1ccc(O)c(C(O)CNCCCCCCOCCCCc2ccccc2)c1)c1ccc2ccccc2c1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 19/20 0.65
KDM4E B2RXH2 2/20 0.65
MEN1 O00255 2/20 0.65
TP53 P04637 2/20 0.65
CYP3A4 P08684 2/20 0.65
MAPK1 P28482 2/20 0.65
KMT2A Q03164 2/20 0.65
GMNN O75496 1/20 0.65
ALDH1A1 P00352 1/20 0.65
LMNA P02545 1/20 0.65
HPGD P15428 1/20 0.65
NFKB1 P19838 1/20 0.65
THPO P40225 1/20 0.65
MTOR P42345 1/20 0.65
RAB9A P51151 1/20 0.65
BLM P54132 1/20 0.65
PMP22 Q01453 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
HSD17B10 Q99714 1/20 0.65
ADRB1 P08588 17/20 0.51

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
Carboxynaphthol SCHEMBL462270 0.88 ADRB2 (0.78) ADRB2KDM4EMEN1TP53CYP3A4
SCHEMBL4637281 0.87 ADRB2 (0.80) ADRB2KDM4EMEN1TP53CYP3A4
Alcohol SCHEMBL17728039 0.84 ADRB2 (0.78) ADRB2KDM4EMEN1TP53CYP3A4
SCHEMBL17728040 0.79 ADRB2 (0.78) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL19211132 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL9806070 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL18070 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL2833182 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL29372524 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4
Salmeterol SCHEMBL29352164 0.79 ADRB2 (1.00) ADRB2KDM4EMEN1TP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992474-A Adrenergic stimulants GLAXO GROUP LTD. (GB) 1991-02-12 US claimed
EP-1937626-B1 Process and intermediates for the preparation of Salmeterol GENERICS UK LTD (GB) 2016-02-17 EP disclosed
US-8648214-B2 Processes suitable for the preparation of salmeterol GENERICS [UK] LIMITED (GB) 2014-02-11 US disclosed
US-8648214-B2 Processes suitable for the preparation of salmeterol GENERICS [UK] LIMITED (GB) 2014-02-11 US disclosed
EP-2641893-A1 PROCESS FOR THE PREPARATION OF SALMETEROL AND ITS SALTS Generics [UK] Limited (GB) 2013-09-25 EP disclosed
EP-2641893-A1 PROCESS FOR THE PREPARATION OF SALMETEROL AND ITS SALTS Generics [UK] Limited (GB) 2013-09-25 EP disclosed
US-20080262267-A1 NOVEL PROCESS GENERICS [UK] LIMITED (GB) 2008-10-23 US disclosed
US-20080262267-A1 NOVEL PROCESS GENERICS [UK] LIMITED (GB) 2008-10-23 US disclosed
EP-1937626-A1 NOVEL PROCESS Merck Generics (UK) Limited (GB) 2008-07-02 EP disclosed
WO-2007045857-A1 NOVEL PROCESS GENERICS (UK) LIMITED (GB) 2007-04-26 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-20080262267-A1 NOVEL PROCESS CYP4A11, HSD3B1, HSD11B1 ADRB2 128/4885KDM4E 396/4885MEN1 4431/4885

“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.