SCHEMBL3862097

SCHEMBL3862097

COc1ccc(C(=O)C2=C(c3ccc(OC)cc3)CCc3cc(OC)ccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.52
ESR2 Q92731 2/20 0.52
MAPT P10636 5/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 5/20 0.45
GLA P06280 2/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 3/20 0.44
MEN1 O00255 1/20 0.44
ALPL P05186 1/20 0.44
CLK1 P49759 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 2/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL6135986 0.95 ESR1 (0.58) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL3976908 0.94 ESR1 (0.55) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL7110390 0.91 ALDH1A1 (0.51) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL7111266 0.90 ESR1 (0.47) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL3861641 0.89 ESR1 (0.55) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL6136110 0.89 ESR1 (0.44) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL11187364 0.88 ESR1 (0.55) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL3861662 0.88 ESR1 (0.60) ESR1ESR2MAPTSMN1; SMN2KDM4E
SCHEMBL3886456 0.87 ESR1 (0.54) ESR1ESR2SMN1; SMN2GAAALDH1A1
SCHEMBL7942835 0.87 ALDH1A1 (0.46) ESR1ESR2MAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-7501441-B1 Naphthyl compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY (US) 2009-03-10 US disclosed
US-6437137-B1 REDUCING (NAPHTHALEN-1-YL)(4-(2-(1-PIPERDINYL)ETHOXY) PHENYL)METHANONE WITH A REDUCING AGENT IN THE PRESENCE OF A SOLVENT, HEATING TO REFLUX; FORMING (NAPHTHALEN-1-YL)(4-(2-(1-PIPERDINYL)ETHOXY)PHENYL)METHANE ELI LILLY AND COMPANY 2002-08-20 US disclosed
EP-0702961-B1 Compositions for minimizing the uterotrophic effect of tamoxifen and its analogs LILLY CO ELI (US) 2002-07-24 EP disclosed
US-6410564-B1 Naphthyl compounds, intermediates, processes, compositions, and methods ELI LILLY AND COMPANY 2002-06-25 US disclosed
EP-0703228-B1 Naphthyl compounds, intermediates, processes, compositions involving them LILLY CO ELI (US) 2002-03-06 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-0702961-A2 Compositions for minimizing the uterotrophic effect of tamoxifen and its analogs ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
EP-0703228-A1 Naphthyl compounds, intermediates, processes, compositions involving them ELI LILLY AND COMPANY (US) 1996-03-27 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-5484797-A Naphthly compounds, intermediates, processes, compositions, and method for inhibiting endometrosis ELI LILLY AND COMPANY (US) 1996-01-16 US disclosed