SCHEMBL3170191

SCHEMBL3170191

CCCCc1cc2ccccc2c(Oc2ccc(C=O)cc2)c1-c1ccc(OC)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.76
ESR2 Q92731 9/20 0.76
TDP1 Q9NUW8 2/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP2A6 P11509 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
ALOX5 P09917 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 1/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37

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
SCHEMBL3181197 0.93 ESR1 (0.76) ESR1ESR2TDP1GAAL3MBTL1
SCHEMBL3181250 0.91 ESR1 (0.77) ESR1ESR2TDP1GAAL3MBTL1
SCHEMBL3178718 0.89 ESR1 (0.67) ESR1ESR2ALDH1A1ALOX5MAPT
SCHEMBL3171957 0.87 ESR1 (1.00) ESR1ESR2
SCHEMBL3171948 0.87 ESR1 (1.00) ESR1ESR2
SCHEMBL3178441 0.86 ESR1 (0.67) ESR1ESR2ALDH1A1ALOX5MAPT
SCHEMBL3179081 0.85 ESR1 (0.68) ESR1ESR2ALDH1A1ALOX5MAPT
SCHEMBL3176317 0.82 ESR1 (0.58) ESR1ESR2ALDH1A1ALOX5MAPT
SCHEMBL3168104 0.80 ESR1 (1.00) ESR1ESR2
SCHEMBL3168086 0.80 ESR1 (1.00) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649093-B2 (2E)-3-[4-[(6-hydroxy-3-methyl-2-phenyl-1-naphthalenyl)oxy]-2-(trifluoromethyl)phenyl]-2-propenoic acid; menopausal or postmenopausal disorders, vasomotor symptoms, vaginal atrophy, atrophic vaginitis, endometriosis, female sexual dysfunction, breast cancer, depression, diabetes, osteoporosis Glaxo Smith Kline LLC (US) 2010-01-19 US disclosed
US-20070276000-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2007-11-29 US disclosed
EP-1773750-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-18 EP disclosed
WO-2006002185-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-01-05 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-20070276000-A1 CHEMICAL COMPOUNDS GPER1, ESR2, ESR1 ESR1 3/4885ESR2 2/4885TDP1 4261/4885

“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.