SCHEMBL9531248

SCHEMBL9531248

CN(C)CC1NCCc2ccsc21

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 8/20 0.52
DRD2 P14416 2/20 0.36
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
PRCP P42785 2/20 0.35
DRD3 P35462 1/20 0.33
SLC22A1 O15245 1/20 0.33
PNMT P11086 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
SCHEMBL3312684 0.78 KMT2A (0.37) TAAR1DRD2HTR1AHTR7PRCP
SCHEMBL12761042 0.77 PARP1 (0.37) TAAR1DRD2HTR1AHTR7PRCP
SCHEMBL9210176 0.76 GID4 (0.49) TAAR1DRD2PRCPDRD3SLC22A1
SCHEMBL4709300 0.74 SLC22A1 (0.59) PRCPSLC22A1
SCHEMBL4709088 0.73 MAOA (0.41) TAAR1DRD2HTR1AHTR7DRD3
SCHEMBL9534305 0.73 TAAR1 (0.55) TAAR1
SCHEMBL12485441 0.73 SLC22A1 (0.43) TAAR1DRD2PRCPSLC22A1
SCHEMBL21248576 0.72 KMT2A (0.58)
SCHEMBL12486539 0.72 BCHE (0.45)
SCHEMBL330217 0.71 PRCP (0.62) PRCPSLC22A1

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-0575362-A1 TETRAHYDROTHIENO(2,3-c)PYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL APPLICATION Smithkline Beecham Farmaceutici S.p.A. (IT) 1993-12-29 EP disclosed
WO-1992015592-A1 TETRAHYDROTHIENO(2,3-c)PYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL APPLICATION SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) 1992-09-17 WO disclosed