SCHEMBL8770271

SCHEMBL8770271

O=C(c1ccc(OCCCCCl)cc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.70
NR4A1 P22736 1/20 0.62
NR4A2 P43354 1/20 0.62
NR4A3 Q92570 1/20 0.62
HTT P42858 4/20 0.61
ALDH1A1 P00352 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
PPARA Q07869 1/20 0.60
MAOB P27338 1/20 0.59
PARP10 Q53GL7 1/20 0.59
RAB9A P51151 3/20 0.58
GAA P10253 2/20 0.58
MAPT P10636 1/20 0.58
PLA2G4B P0C869 1/20 0.55
NPC1 O15118 2/20 0.54
PPARG P37231 1/20 0.54
MGLL Q99685 1/20 0.54
KDM4E B2RXH2 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL8770138 0.89 PPARA (0.73) SRD5A2ALDH1A1L3MBTL1PPARAPARP10
SCHEMBL15796970 0.88 PPARA (0.71) ALDH1A1L3MBTL1PPARAGAAMAPT
SCHEMBL3232949 0.87 SRD5A2 (0.90) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL402300 0.86 SRD5A2 (0.87) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL1469758 0.84 GAA (0.72) SRD5A2HTTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6899078 0.83 NR4A1 (0.56) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL8503299 0.83 SRD5A2 (0.77) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL3415530 0.83 SRD5A2 (0.81) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL6893992 0.82 NR4A1 (0.55) SRD5A2NR4A1NR4A2NR4A3HTT
SCHEMBL11485988 0.82 PPARA (0.83) SRD5A2HTTALDH1A1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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