SCHEMBL3958571

SCHEMBL3958571

O=C(Cc1ccc(F)cc1)c1ccc(O)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
HTT P42858 2/20 1.00
ESR1 P03372 1/20 0.81
SHBG P04278 1/20 0.81
ESR2 Q92731 1/20 0.81
MAPT P10636 5/20 0.71
RAB9A P51151 4/20 0.71
NPC1 O15118 3/20 0.71
GAA P10253 2/20 0.71
ALOX12 P18054 1/20 0.71
ALDH1A1 P00352 3/20 0.66
MEN1 O00255 2/20 0.66
HPGD P15428 2/20 0.66
KMT2A Q03164 2/20 0.66
CYP3A4 P08684 1/20 0.66
ATM Q13315 1/20 0.66
TP53 P04637 3/20 0.63
MAPK1 P28482 2/20 0.63
KDM4E B2RXH2 2/20 0.63

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
SCHEMBL312243 0.90 ESR1 (1.00) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL30503014 0.90 ESR1 (1.00) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL22925087 0.87 LMNA (0.77) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL29574422 0.87 LMNA (0.77) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL16322177 0.87 LMNA (0.77) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL17637167 0.84 LMNA (0.72) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL2331741 0.83 LMNA (1.00) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL38652384 0.83 ESR1 (0.81) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL22672221 0.83 ESR1 (0.81) LMNASMN1; SMN2HTTESR1SHBG
SCHEMBL3586687 0.83 ESR1 (0.81) LMNASMN1; SMN2HTTESR1SHBG

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3010502-B1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS INC (US) 2018-11-21 EP disclosed
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2017-12-21 US disclosed
US-9655880-B2 Azetidine estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2017-05-23 US disclosed
US-9655880-B2 Azetidine estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2017-05-23 US disclosed
US-9655880-B2 Azetidine estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2017-05-23 US disclosed
US-20160367526-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-12-22 US disclosed
US-20160367526-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-12-22 US disclosed
US-20160367526-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-12-22 US disclosed
WO-2016174551-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-11-03 WO disclosed
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-10-27 US disclosed
EP-3010502-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF Seragon Pharmaceuticals, Inc. (US) 2016-04-27 EP disclosed
US-20160090377-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-03-31 US disclosed
US-20160090377-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-03-31 US disclosed
US-20160090377-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-03-31 US disclosed
WO-2014205136-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS, INC. (US) 2014-12-24 WO disclosed
WO-2014205136-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS, INC. (US) 2014-12-24 WO disclosed
WO-2009026657-A1 FLAVONOID PPAR AGONISTS THE UNIVERSITY OF SYDNEY (AU) 2009-03-05 WO disclosed
WO-2009026658-A1 PPAR AGONISTS THE UNIVERSITY OF SYDNEY (AU) 2009-03-05 WO disclosed
WO-2009026657-A1 FLAVONOID PPAR AGONISTS THE UNIVERSITY OF SYDNEY (AU) 2009-03-05 WO disclosed
WO-2009026658-A1 PPAR AGONISTS THE UNIVERSITY OF SYDNEY (AU) 2009-03-05 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 (4 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-20160090377-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR1, ESR2, GPER1 LMNA 4219/4885SMN1; SMN2 4543/4885HTT 2825/4885
US-20160367526-A1 AZETIDINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR1, ESR2, GPER1 LMNA 4219/4885SMN1; SMN2 4543/4885HTT 2825/4885
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS ESR1, ESRRA, ESR2 LMNA 1522/4885SMN1; SMN2 2796/4885HTT 3174/4885
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS ESR1, ESRRA, ESR2 LMNA 1522/4885SMN1; SMN2 2796/4885HTT 3174/4885

“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.