SCHEMBL3861641

SCHEMBL3861641

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.55
ESR2 Q92731 5/20 0.55
EBP Q15125 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
MAPT P10636 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
MCHR1 Q99705 2/20 0.39
KDM4E B2RXH2 4/20 0.38
GLA P06280 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 2/20 0.38
MEN1 O00255 1/20 0.38
ALPL P05186 1/20 0.38
CLK1 P49759 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL7106880 0.91 ESR1 (0.51) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL3862097 0.89 ESR1 (0.52) ESR1ESR2MAPTSMN1; SMN2TP53
SCHEMBL7111025 0.89 ESR1 (0.47) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL7523729 0.88 MCHR1 (0.54) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL3886456 0.88 ESR1 (0.54) ESR1ESR2EBPSIGMAR1SMN1; SMN2
SCHEMBL7109898 0.88 ESR1 (0.51) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL7112981 0.86 ESR1 (0.47) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL7110416 0.86 ESR1 (0.51) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL13899516 0.86 ESR1 (0.52) ESR1ESR2EBPSIGMAR1MAPT
SCHEMBL11186217 0.85 ESR1 (0.77) ESR1ESR2EBPSIGMAR1MCHR1

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
EP-0703228-A1 Naphthyl compounds, intermediates, processes, compositions involving them ELI LILLY AND COMPANY (US) 1996-03-27 EP disclosed
EP-0702962-A2 Preparations for inhibiting mammalian breast carcinoma with tamoxifen and analogs thereof, and certain naphthyl compounds ELI LILLY AND COMPANY (US) 1996-03-27 EP 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
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