SCHEMBL8624418

SCHEMBL8624418

CN(C)CCSc1ccc(C=O)s1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 8/20 0.54
HTR7 P34969 7/20 0.38
HTR1A P08908 2/20 0.38
HTR2A P28223 2/20 0.38
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.36
KAT2B Q92831 1/20 0.35
DRD2 P14416 1/20 0.34

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
SCHEMBL7361138 0.88 SERPINE1 (0.44) SERPINE1ALDH1A1
SCHEMBL8238043 0.79 SERPINE1 (0.49) SERPINE1HTR7HTR1AHTR2AALDH1A1
SCHEMBL4724956 0.78 ALDH1A1 (0.45) SERPINE1ALDH1A1
SCHEMBL8633515 0.77 ALDH1A1 (0.46) SERPINE1ALDH1A1
SCHEMBL9724168 0.77 ALDH1A1 (0.44) SERPINE1ALDH1A1
SCHEMBL11711430 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11713091 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11720811 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL17483811 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11713052 0.75 ALDH1A1 (0.42) ALDH1A1

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
US-5750530-A PLASMINOGEN ACTIVATOR INHIBITORS XENOVA LIMITED (GB) 1998-05-12 US disclosed