SCHEMBL5205310

SCHEMBL5205310

CS(=O)(=O)N(C(=O)OCc1ccccc1)c1cc(OC[C@H]2CO2)ccc1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
PKM P14618 2/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
CYP19A1 P11511 7/20 0.40
FFAR1 O14842 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
MGLL Q99685 2/20 0.39
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL5205302 1.00 ALDH1A1 (0.40) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL3142767 0.90 MEN1 (0.40) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL5203422 0.90 MEN1 (0.40) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL3142761 0.90 MEN1 (0.40) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL3287624 0.83 ALDH1A1 (0.43) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL3287626 0.83 ALDH1A1 (0.43) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL7611451 0.83 APP (0.42) ALDH1A1PKMLMNACYP19A1
SCHEMBL7611458 0.83 APP (0.42) ALDH1A1PKMLMNACYP19A1
SCHEMBL6074644 0.83 ALDH1A1 (0.43) ALDH1A1PKMLMNAGAACYP19A1
SCHEMBL3289538 0.82 KEAP1 (0.40) ALDH1A1PKMLMNAGAAFFAR1

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 disclosed
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 ALDH1A1 1619/4885PKM 1951/4885LMNA 865/4885

“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.