Benzothiophene

Benzothiophene

SCHEMBL28545602

c1ccc2sccc2c1.c1ccc2sccc2c1.c1ccc2sccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.42
CA9 Q16790 2/20 0.42
CYP2A6 P11509 7/20 0.41
GPR3 P46089 1/20 0.41
CTNNB1 P35222 2/20 0.40
WNT3A P56704 2/20 0.40
ALOX12 P18054 1/20 0.39
DYRK1A Q13627 1/20 0.38
PTPRC P08575 1/20 0.37
PTPN6 P29350 1/20 0.37
PTPN11 Q06124 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37
CA2 P00918 1/20 0.35
ASIC3 Q9UHC3 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
Benzothiophene SCHEMBL28399890 1.00 CA12 (0.42) CA12CA9CYP2A6GPR3CTNNB1
Benzothiophene SCHEMBL451494 1.00
Benzothiophene SCHEMBL29415494 1.00
Benzothiophene SCHEMBL7023 1.00
Benzothiophene SCHEMBL253491 1.00 CA12 (0.42) CA12CA9CYP2A6GPR3CTNNB1
Benzothiophene SCHEMBL27873783 1.00 CA12 (0.42) CA12CA9CYP2A6GPR3CTNNB1
Benzothiophene SCHEMBL29383883 1.00
Naphthalene SCHEMBL23236453 0.97 CYP2A6 (0.44) CA12CA9CYP2A6GPR3CTNNB1
Benzothiophene SCHEMBL4334236 0.97 CA12 (0.41) CA12CA9CYP2A6GPR3CTNNB1
Benzothiophene SCHEMBL2495738 0.97 CA12 (0.41) CA12CA9CYP2A6GPR3CTNNB1

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
CN-110534650-B Self-filtering narrow-spectral-response organic photodetector 华南理工大学 2021-08-10 CN disclosed
CN-112635676-A Visible blind near-infrared narrow-band organic photoelectric detector 华南理工大学 2021-04-09 CN disclosed