SCHEMBL3179495

SCHEMBL3179495

CCOC(=O)C=C(Cc1cccc(OC)c1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 3/20 0.45
KDM4E B2RXH2 1/20 0.45
TAAR1 Q96RJ0 2/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 2/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL30768637 0.84 CTBP2 (0.49) CTBP2ALDH1A1MAPTKDM4EMAPK1
SCHEMBL17204261 0.83 CTBP2 (0.48) CTBP2ALDH1A1MAPTKDM4ETAAR1
SCHEMBL17204262 0.83 CTBP2 (0.48) CTBP2ALDH1A1MAPTKDM4ETAAR1
SCHEMBL30172840 0.83 CTBP2 (0.48) CTBP2ALDH1A1MAPTKDM4ETAAR1
SCHEMBL7640178 0.78 CTBP2 (0.54) CTBP2ALDH1A1MAPTKDM4EMAPK1
SCHEMBL511950 0.78 POLB (0.56) CTBP2ALDH1A1MAPTKDM4EMAPK1
SCHEMBL29640755 0.78 POLB (0.56) CTBP2ALDH1A1MAPTKDM4EMAPK1
SCHEMBL6897029 0.77 CES2 (0.54) ALDH1A1MAPTKDM4EMAPK1TSHR
SCHEMBL3175855 0.76 CTBP2 (0.57) CTBP2ALDH1A1TAAR1MEN1KMT2A
SCHEMBL3179500 0.73 CTBP2 (0.49) CTBP2ALDH1A1TAAR1MEN1KMT2A

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 CTBP2 2378/4885ALDH1A1 586/4885MAPT 2697/4885

“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.