SCHEMBL6135986

SCHEMBL6135986

COc1ccc(C2=C(C(=O)c3ccc(O)cc3)c3ccc(OC)cc3CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.58
ESR2 Q92731 6/20 0.58
CYP26A1 O43174 2/20 0.48
MIF P14174 2/20 0.48
CYP24A1 Q07973 1/20 0.46
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
KDM4E B2RXH2 3/20 0.42
GLA P06280 2/20 0.42
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
ALPL P05186 1/20 0.41
CLK1 P49759 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL3862097 0.95 ESR1 (0.52) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL3861662 0.93 ESR1 (0.60) ESR1ESR2CYP26A1MIFCYP24A1
SCHEMBL9054865 0.91 ESR1 (0.60) ESR1ESR2CYP26A1MIFCYP24A1
SCHEMBL9571848 0.91 ESR1 (0.51) ESR1ESR2CYP26A1MIFMAPT
SCHEMBL7107472 0.90 ESR1 (0.52) ESR1ESR2CYP26A1MIFCYP24A1
SCHEMBL7108932 0.90 ESR1 (0.52) ESR1ESR2CYP26A1MIFCYP24A1
SCHEMBL3976908 0.89 ESR1 (0.55) ESR1ESR2MIFMAPTSMN1; SMN2
SCHEMBL7942846 0.88 ESR1 (0.51) ESR1ESR2MAPTSMN1; SMN2KDM4E
SCHEMBL7110390 0.86 ALDH1A1 (0.51) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL11187364 0.86 ESR1 (0.55) ESR1ESR2MAPTSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107406424-B Estrogen receptor modulators and uses thereof 豪夫迈·罗氏有限公司 2020-08-25 CN disclosed
EP-3233828-B1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2020-03-04 EP disclosed
US-9845291-B2 Estrogen receptor modulators and uses thereof GENENTECH, INC. (US) 2017-12-19 US disclosed
EP-3233828-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2017-10-25 EP disclosed
US-20170197915-A9 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2017-07-13 US disclosed
US-20160304450-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GENENTECH, INC. (US) 2016-10-20 US disclosed
WO-2016097071-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2016-06-23 WO disclosed
US-7501441-B1 Naphthyl compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 2009-03-10 US disclosed
US-7501441-B1 Naphthyl compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 2009-03-10 US disclosed
EP-0895989-B1 1-[4-(Substituted alkoxy)benzyl] naphthalene compounds having estrogen inhibitory activity LILLY CO ELI (US) 2005-05-18 EP disclosed
US-5658931-A ADMINISTERING A MIXTURE OF ANTIESTROGENS ELI LILLY AND COMPANY (US) 1997-08-19 US disclosed
US-5554628-A A 1-(4-ALKOXYPHENYL-)NAPHTHALENE COMPOUND ELI LILLY AND COMPANY (US) 1996-09-10 US disclosed
WO-1996009052-A1 A METHOD FOR INHIBITING MAMMALIAN BREAST CARCINOMA WITH TAMOXIFEN, AND ANALOGS THEREOF, AND CERTAIN NAPHTHYL COMPOUNDS ELI LILLY AND COMPANY (US) 1996-03-28 WO disclosed
WO-1996009039-A1 NAPHTHYL COMPOUNDS, INTERMEDIATES, PROCESSES, COMPOSITIONS, AND METHODS ELI LILLY AND COMPANY (US) 1996-03-28 WO disclosed
EP-0524742-B1 Benzo(a)fluorene compounds LILLY CO ELI (US) 1996-02-28 EP disclosed
US-5484796-A Naphthyl compounds, intermediates, processes, compositions, and method of inhibiting aortal smooth muscle cell proliferation ELI LILLY AND COMPANY (US) 1996-01-16 US disclosed
US-5484795-A Naphthyl compounds, intermediates, processes, compositions, and method of inhibiting restenosis ELI LILLY AND COMPANY (US) 1996-01-16 US disclosed
US-4400543-A ANTIFERTILITY AGENTS ELI LILLY AND COMPANY (US) 1983-08-23 US disclosed
US-4323707-A USEFUL FOR AMIMALS, AROYL-PHENYL-NAPHTHALENES OR DIHYDRONAPHTHALENES ELI LILLY AND COMPANY (US) 1982-04-06 US disclosed
US-4230862-A 3-PHENYL-4-AROYL-1,2-DIHYDRONAPHTHALENES AND 1-ARYOYL-2-PHENYLNAPHTHALENES ELI LILLY AND COMPANY (US) 1980-10-28 US 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 (2 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-20170197915-A9 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR2, ESR1, GPER1 ESR1 2/4885ESR2 1/4885CYP26A1 87/4885
US-20160304450-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR2, ESR1, GPER1 ESR1 2/4885ESR2 1/4885CYP26A1 87/4885

“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.