SCHEMBL8700819

SCHEMBL8700819

Cc1[c]cccc1Oc1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.45
SLC6A4 P31645 7/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HTT P42858 2/20 0.41
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL5903538 0.83 TSHR (0.42) SLC6A4SLC6A2SLC6A3HTTALDH1A1
SCHEMBL5880503 0.81 HTR2A (0.44) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL919270 0.79 MAPT (0.43) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL8700822 0.79 MAOA (0.38) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL12653055 0.73 HTR2A (0.54) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL10469324 0.72 GAA (0.45) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL8123557 0.72 PDE7A (0.43) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL8124447 0.71 LMNA (0.47) HTTALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL16891287 0.71 HTR2A (0.47) HTR2ASLC6A4SLC6A2SLC6A3HTT
SCHEMBL11408377 0.70 HTR2A (0.50) HTR2ASLC6A4SLC6A2SLC6A3HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998017631-A2 SUBSTITUTED OXIME-ETHERS AND THEIR USE AS PESTICIDES NOVARTIS AG (CH) 1998-04-30 WO disclosed