SCHEMBL8770563

SCHEMBL8770563

CCN(CC)CCCCOc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 9/20 0.76
ACHE P22303 9/20 0.76
PPARA Q07869 2/20 0.62
LSS P48449 2/20 0.62
GAA P10253 1/20 0.59
KCNH2 Q12809 2/20 0.58
EBP Q15125 2/20 0.58
SIGMAR1 Q99720 2/20 0.58
ESR1 P03372 2/20 0.58
CHRM2 P08172 2/20 0.58
ADRA2A P08913 2/20 0.58
ADORA3 P0DMS8 2/20 0.58
CHRM1 P11229 2/20 0.58
PTGS1 P23219 2/20 0.58
SLC6A2 P23975 2/20 0.58
SLC6A4 P31645 2/20 0.58
DRD3 P35462 2/20 0.58
HTR6 P50406 2/20 0.58
SLC6A3 Q01959 2/20 0.58
KMT2A Q03164 2/20 0.58

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
SCHEMBL9360240 0.99 BCHE (0.78) BCHEACHEPPARALSSGAA
SCHEMBL13305510 0.96 BCHE (0.77) BCHEACHEPPARAGAAKCNH2
SCHEMBL5810064 0.91 EBP (0.68) BCHEACHEPPARAGAAKCNH2
SCHEMBL9360200 0.89 BCHE (0.69) BCHEACHEPPARALSSGAA
SCHEMBL12795314 0.88 BCHE (0.67) BCHEACHEPPARALSSGAA
SCHEMBL9364383 0.85 LSS (0.68) BCHEACHEPPARALSSGAA
SCHEMBL11485988 0.84 PPARA (0.83) PPARALSSGAAKDM4EMAPT
SCHEMBL9360056 0.84 LSS (0.70) BCHEACHEPPARALSSGAA
SCHEMBL9360140 0.84 LSS (0.70) BCHEACHEPPARALSSGAA
SCHEMBL9360007 0.84 LSS (0.70) BCHEACHEPPARALSSGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1167437-A Method of using triaryl-ethylene derivatives in the treatment and prevention of osteoporosis HOECHST MARION ROUSSEL INC (US) 1997-12-10 CN disclosed
US-5693674-A Method of using triaryl-ethylene derivatives in the treatment and prevention of osteoporosis HOECHST MARION ROUSSEL, INC. (US) 1997-12-02 US disclosed
US-5691384-A Method of using triaryl-ethylene derivatives in the treatment and prevention of osteoporosis HOECHST MARION ROUSSEL, INC. (US) 1997-11-25 US disclosed
EP-0794771-A1 METHOD OF USING TRIARYL-ETHYLENE DERIVATIVES IN THE TREATMENT AND PREVENTION OF OSTEOPOROSIS HOECHST MARION ROUSSEL, INC. (US) 1997-09-17 EP disclosed
WO-1996016646-A1 METHOD OF USING TRIARYL-ETHYLENE DERIVATIVES IN THE TREATMENT AND PREVENTION OF OSTEOPOROSIS HOECHST MARION ROUSSEL, INC. (US) 1996-06-06 WO disclosed