SCHEMBL4651972

SCHEMBL4651972

COc1ccc(C2=C(C(=O)c3ccc(OCCN(C)C)cc3)c3ccccc3CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.52
ESR2 Q92731 7/20 0.52
CNR1 P21554 4/20 0.47
BCHE P06276 3/20 0.47
CNR2 P34972 2/20 0.47
MCHR1 Q99705 1/20 0.46
CACNA1B Q00975 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
DRD2 P14416 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
ACHE P22303 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
SCHEMBL11187322 0.93 ESR1 (0.55) ESR1ESR2CNR1BCHEMCHR1
SCHEMBL11192824 0.92 ESR1 (0.48) ESR1ESR2CNR1BCHEMCHR1
SCHEMBL11178289 0.92 ESR1 (0.50) ESR1ESR2BCHEMCHR1CACNA1B
SCHEMBL4653145 0.90 MCHR1 (0.54) ESR1ESR2CNR1BCHECNR2
SCHEMBL3886456 0.90 ESR1 (0.54) ESR1ESR2CNR1BCHECNR2
SCHEMBL4651133 0.89 MCHR1 (0.58) ESR1ESR2CNR1BCHECNR2
SCHEMBL7942835 0.87 ALDH1A1 (0.46) ESR1ESR2CNR1CNR2SMN1; SMN2
SCHEMBL27604706 0.86 LTA4H (0.47) ESR1ESR2CNR1BCHECNR2
SCHEMBL7946063 0.84 ESR1 (0.49) ESR1ESR2SMN1; SMN2ALDH1A1GAA
Trioxifene SCHEMBL4651963 0.83 ESR1 (0.69) ESR1ESR2MCHR1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127440-A1 Methods and compositions for control of bone formation via modulation of neuropeptide Y activity BAYLOR COLLEGE OF MEDICINE 2004-07-01 US claimed
US-20040053864-A1 Methods and compositions for control of bone formation via modulation of neuropeptide y activity BAYLOR COLLEGE OF MEDICINE 2004-03-18 US claimed
WO-2001053477-A1 METHODS AND COMPOSITIONS FOR CONTROL OF BONE FORMATION VIA MODULATION OF NEUROPEPTIDE Y ACTIVITY BAYLOR COLLEGE OF MEDICINE (US) 2001-07-26 WO claimed
EP-0735821-A4 METHODS FOR THE TREATMENT OR PREVENTION OF CONDITIONS ASSOCIATED WITH AMYLOIDOGENIC REPTIDES LILLY CO ELI (US) 1998-04-01 EP claimed
EP-0736007-A4 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 1997-03-19 EP claimed
EP-0736007-A1 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-10-09 EP claimed
EP-0735821-A1 METHODS FOR THE TREATMENT OR PREVENTION OF CONDITIONS ASSOCIATED WITH AMYLOIDOGENIC REPTIDES ELI LILLY AND COMPANY (US) 1996-10-09 EP claimed
EP-0716854-A2 Compositions for inhibiting neuropeptide y receptors ELI LILLY AND COMPANY (US) 1996-06-19 EP claimed
US-5514675-A ADMINISTERING TO TREAT ASTHMA, RHINITIS, AND PAIN; ANTISHOCK AND HYPOTENSIVE AGENTS ELI LILLY AND COMPANY (US) 1996-05-07 US claimed
WO-1996012489-A1 BICYCLIC NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-05-02 WO claimed
WO-1996012488-A1 BICYCLIC BRADYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-05-02 WO claimed
EP-0709090-A2 Compositions for treating resistant tumors ELI LILLY AND COMPANY (US) 1996-05-01 EP claimed
WO-1996011677-A1 METHODS FOR TREATING RESISTANT TUMORS ELI LILLY AND COMPANY (US) 1996-04-25 WO claimed
EP-0707852-A2 Bicyclic bradykinin receptor antagonists ELI LILLY AND COMPANY (US) 1996-04-24 EP claimed
US-5491140-A ADMINISTERING TO A MAMMAL SUFFERING FROM NERVOUS SYSTEM DISORDERS, RESPIRATORY SYSTEM DISORDERS, UROGENITAL DISORDERS ARTHRITIS, RHEUMATOID, OSTEOPROSIS, PERSISTENT PAIN, MIGRAIN OR POST-OPERATIVE PAIN ELI LILLY AND COMPANY (US) 1996-02-13 US claimed
WO-1995017095-A1 METHODS FOR THE TREATMENT OR PREVENTION OF CONDITIONS ASSOCIATED WITH AMYLOIDOGENIC REPTIDES ELI LILLY AND COMPANY (US) 1995-06-29 WO claimed
WO-1995017382-A1 NON-PEPTIDE TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1995-06-29 WO claimed
EP-2002827-A2 Methods and compositions for control of bone formation via modulation of sympathetic tone THE BAYLOR COLLEGE OF MEDICINE (US) 2008-12-17 EP disclosed
US-4237162-A MITICIDES, LARVACIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-02 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