SCHEMBL6002379

SCHEMBL6002379

Fc1ccccc1Cc1cncs1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.41
ABL1 P00519 1/20 0.41
SLC6A2 P23975 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
DAO P14920 1/20 0.38
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
AR P10275 1/20 0.36

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
SCHEMBL23223243 0.79 SLC6A3 (0.43) SLC6A3SLC6A2DAOSMN1; SMN2
SCHEMBL28752736 0.79 LMNA (0.47) SLC6A3SLC6A2TAAR1TDP1
SCHEMBL9389496 0.73 SLC6A3 (0.49) SLC6A3SLC6A2TDP1
SCHEMBL9024874 0.72 HPGD (0.54) ABL1TAAR1SMN1; SMN2
SCHEMBL3301625 0.71 TAAR1 (0.59) TAAR1DAOAR
SCHEMBL765420 0.70 SLC6A3 (0.51) SLC6A3ABL1SLC6A2TP53SMN1; SMN2
SCHEMBL16051513 0.69 ALDH1A1 (0.44) ABL1SMN1; SMN2
SCHEMBL963467 0.69 EPHX2 (0.49) ABL1TAAR1ADORA2AADORA1TP53
SCHEMBL2091427 0.68 HDAC3 (0.34) SLC6A3SLC6A2TDP1
SCHEMBL4758082 0.68 ADRA1D (0.51) SLC6A3TAAR1SMN1; SMN2TDP1

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
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed