SCHEMBL5206971

SCHEMBL5206971

CS(=O)(=O)N(C(=O)OCc1ccccc1)c1cc(O)ccc1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.47
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ELANE P08246 4/20 0.41
EGFR P00533 2/20 0.41
F2 P00734 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
CTSG P08311 1/20 0.40
SRC P12931 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL5203737 0.87 CYP19A1 (0.47) CYP19A1MAPTTDP1L3MBTL1ALDH1A1
SCHEMBL7467733 0.87 CYP19A1 (0.44) CYP19A1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL6139688 0.85 CYP19A1 (0.45) CYP19A1MAPTCYP2C9CYP2C19SMN1; SMN2
Acetic Acid SCHEMBL6139684 0.85 CYP19A1 (0.48) CYP19A1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL7606241 0.83 CYP19A1 (0.41) CYP19A1FFAR4
SCHEMBL7611458 0.82 APP (0.42) CYP19A1MAPTFFAR4ALDH1A1
SCHEMBL7606232 0.82 CYP19A1 (0.41) CYP19A1
SCHEMBL7611451 0.82 APP (0.42) CYP19A1MAPTFFAR4ALDH1A1
SCHEMBL5205310 0.80 ALDH1A1 (0.40) CYP19A1SMN1; SMN2TDP1ALDH1A1
SCHEMBL5205302 0.80 ALDH1A1 (0.40) CYP19A1SMN1; SMN2TDP1ALDH1A1

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 5 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
EP-1242083-A1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Sanofi-Aventis (FR) 2002-09-25 EP disclosed
WO-2001043744-A1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2001-06-21 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-20030040530-A1 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containning them CNR1, CORO1C, CBR1 CYP19A1 1050/4885MAPT 2110/4885CYP2C9 117/4885

“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.