SCHEMBL1013393

SCHEMBL1013393

N#Cc1cc(O)c2ccn(-c3ccc(OCc4ccccc4)c(F)c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 1/20 0.37
MAOB P27338 2/20 0.36
FFAR4 Q5NUL3 1/20 0.36
SLC6A9 P48067 1/20 0.35
ERN1 O75460 1/20 0.35
CYP19A1 P11511 1/20 0.35
STK10 O94804 1/20 0.35
SLK Q9H2G2 1/20 0.35

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
SCHEMBL1727591 0.88 MAOB (0.36) S1PR5MAOBFFAR4STK10SLK
SCHEMBL13748521 0.88 MRGPRX4 (0.40) S1PR5MAOBSLC6A9ERN1CYP19A1
SCHEMBL1016697 0.86 S1PR5 (0.40) S1PR5MAOBERN1
SCHEMBL2006324 0.82 MAPT (0.37) S1PR5MAOB
SCHEMBL12532042 0.82 S1PR5 (0.37) S1PR5MAOBFFAR4ERN1
SCHEMBL1727693 0.79 AR (0.40) FFAR4CYP19A1
SCHEMBL1014598 0.77 ROCK1 (0.53) S1PR5FFAR4
SCHEMBL1013518 0.76 S1PR5 (0.38) S1PR5
SCHEMBL1728482 0.76 S1PR5 (0.39) S1PR5FFAR4ERN1
SCHEMBL1014177 0.75 ROCK1 (0.43) S1PR5FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012009617-A3 METHODS, STORAGE MEDIUMS, AND SYSTEMS FOR ANALYZING PARTICLE QUANTITY AND DISTRIBUTION WITHIN AN IMAGING REGION OF AN ASSAY ANALYSIS SYSTEM AND FOR EVALUATING THE PERFORMANCE OF A FOCUSING ROUTING PERFORMED ON AN ASSAY ANALYSIS SYSTEM LUMINEX CORPORATION (US) 2012-05-10 WO disclosed
EP-2271617-B1 SUBSTITUTED 4-HYDROXY-N- (4-HYDROXYPHENYL) INDOLES AS ESTROGENIC AGENTS GLAXO GROUP LTD (GB) 2011-11-30 EP disclosed
US-7956083-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-06-07 US disclosed
US-7956083-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-06-07 US disclosed
EP-2271617-A1 SUBSTITUTED 4-HYDROXY-N- (4-HYDROXYPHENYL) INDOLES AS ESTROGENIC AGENTS Glaxo Group Limited (GB) 2011-01-12 EP disclosed
US-20100324106-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-12-23 US disclosed
US-20100324106-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-12-23 US disclosed
WO-2009103710-A1 SUBSTITUTED 4-HYDROXY-N- (4-HYDROXYPHENYL) INDOLES AS ESTROGENIC AGENTS GLAXO GROUP LIMITED (GB) 2009-08-27 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-20100324106-A1 COMPOUNDS ESR2, GPER1, ESR1 S1PR5 893/4885MAOB 188/4885FFAR4 244/4885

“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.