SCHEMBL5204860

SCHEMBL5204860

CCOC(=O)c1ccc(N2CCC(NC[C@H](O)COc3cccc(S(=O)(=O)NC)c3O)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ADRB3 P13945 12/20 0.42
ADRB1 P08588 6/20 0.42
ADRB2 P07550 4/20 0.42
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.40
ABCB11 O95342 1/20 0.39

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
SCHEMBL5203687 0.85 ADRB3 (0.47) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL5210039 0.84 MEN1 (0.43) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL6309214 0.82 MEN1 (0.46) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL5202580 0.79 ADRB3 (0.55) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL6074794 0.79 ADRB3 (0.60) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL5205600 0.79 ADRB3 (0.50) ADRB3ADRB1ADRB2LMNA
SCHEMBL6308613 0.78 MAPT (0.42) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL5243505 0.76 LMNA (0.44) MEN1KMT2AADRB3ADRB1ADRB2
SCHEMBL5202975 0.75 ADRB3 (0.61) ADRB3ADRB1ADRB2
SCHEMBL5206769 0.73 ADRB3 (0.52) ADRB3ADRB1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242083-B1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI AVENTIS (FR) 2007-03-14 EP claimed
US-6867220-B2 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containing them SANOFI-SYNTHELABO (FR) 2005-03-15 US disclosed
US-20030040530-A1 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containning them SANOFI-AVENTIS (FR) 2003-02-27 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-20030040530-A1 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containning them CNR1, CORO1C, CBR1 MEN1 3014/4885KMT2A 2208/4885ADRB3 8/4885

“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.