SCHEMBL8634790

SCHEMBL8634790

COc1ccc(-c2cc(OC)cc(OC)c2C(=O)c2csc3ccccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 2/20 0.48
HPGD P15428 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CNR2 P34972 4/20 0.47
CNR1 P21554 2/20 0.47
TUBB4A P04350 4/20 0.44
TUBB P07437 4/20 0.44
TUBA3C P0DPH7 4/20 0.44
TUBA1B P68363 4/20 0.44
TUBA4A P68366 4/20 0.44
TUBB4B P68371 4/20 0.44
TUBB3 Q13509 4/20 0.44
TUBB2A Q13885 4/20 0.44
TUBB8 Q3ZCM7 4/20 0.44

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
SCHEMBL8637426 0.91 MAPT (0.47) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8635922 0.90 MAPT (0.43) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8632802 0.90 MAPT (0.43) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8336809 0.89 CNR2 (0.47) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8634148 0.88 MEN1 (0.42) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8633868 0.88 MAPT (0.44) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8336291 0.83 MAPT (0.43) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8337435 0.83 MAPT (0.46) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8336438 0.83 CNR2 (0.46) MAPTKDM4EMEN1HPGDKMT2A
SCHEMBL8334430 0.82 CNR2 (0.41) MAPTKDM4EMEN1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5808061-A Intermediates and processes for preparing benzothiophene compounds ELI LILLY AND COMPANY (US) 1998-09-15 US disclosed
US-5747524-A BENZOTHIOPHENES AND BENZOFURANS ELI LILLY AND COMPANY (US) 1998-05-05 US disclosed
EP-0675121-A1 Novel intermediates and processes for preparing benzothiophene compounds ELI LILLY AND COMPANY (US) 1995-10-04 EP disclosed