SCHEMBL8936827

SCHEMBL8936827

Cc1cc(Cl)ccc1Oc1ccc2ccccc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.67
LMNA P02545 1/20 0.67
MAPT P10636 1/20 0.67
PARG Q86W56 2/20 0.55
SLC6A4 P31645 3/20 0.55
CYP2A6 P11509 2/20 0.52
SLC6A2 P23975 1/20 0.49
SLC6A3 Q01959 1/20 0.49
GAA P10253 1/20 0.49
RCE1 Q9Y256 1/20 0.49
PPARG P37231 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
HTR2A P28223 1/20 0.44
KCNH2 Q12809 1/20 0.44
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 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
SCHEMBL13749562 0.82 CYP1A2 (0.62) LMNAMAPTSLC6A4SLC6A2SLC6A3
SCHEMBL10702984 0.82 CYP1A2 (0.58) MAPTSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL28286771 0.80 GAA (0.57) HTTLMNAMAPTPARGSLC6A4
SCHEMBL807773 0.78 SLC6A2 (0.59) LMNAMAPTSLC6A4SLC6A2SLC6A3
SCHEMBL13997359 0.78 L3MBTL1 (0.47) HTTLMNAMAPTPARGSLC6A4
SCHEMBL10828212 0.77 CYP1A2 (0.49) LMNAMAPTSLC6A4SLC6A2SLC6A3
SCHEMBL4441083 0.77 SLC6A2 (0.64) MAPTSLC6A4SLC6A2SLC6A3L3MBTL1
SCHEMBL8936811 0.76 HTT (0.61) HTTLMNAMAPTPARGSLC6A4
SCHEMBL10828216 0.76 MEN1 (0.47) MAPTSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL20565912 0.76 MAOA (0.57) HTTLMNAMAPTSLC6A4SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587392-A THERAPY FOR ESTROGEN DEPENDENT DISEASES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed
EP-0684235-A1 Novel azolyl methyl phenyl derivatives having aromatase inhibitory activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-11-29 EP disclosed