SCHEMBL5190741

SCHEMBL5190741

CCc1cccc(F)c1SC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.41
GABRB2 P47870 4/20 0.41
RIPK1 Q13546 2/20 0.40
LMNA P02545 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TAAR1 Q96RJ0 3/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 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
SCHEMBL9805899 0.85 GABRA1 (0.43) GABRA1GABRB2RIPK1LMNAL3MBTL1
SCHEMBL3122412 0.79 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL13895541 0.77 GABRA1 (0.43) GABRA1GABRB2LMNATAAR1ALDH1A1
SCHEMBL1993383 0.75 GABRA1 (0.38) GABRA1GABRB2LMNAL3MBTL1ALDH1A1
SCHEMBL31675131 0.73 RIPK1 (0.49) GABRA1GABRB2RIPK1LMNATAAR1
SCHEMBL266645 0.73 RIPK1 (0.49) GABRA1GABRB2RIPK1LMNATAAR1
SCHEMBL9193804 0.72 GABRA1 (0.52) GABRA1GABRB2L3MBTL1TAAR1
SCHEMBL9190050 0.72 GABRA1 (0.52) GABRA1GABRB2L3MBTL1TAAR1
SCHEMBL29943841 0.72
SCHEMBL138361 0.72

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-1807394-A1 PROCESS FOR THE SYNTHESIS OF 4-(3-SULFONYLPHENYL)-PIPERIDINES Neurosearch Sweden AB (SE) 2007-07-18 EP disclosed
WO-2006040156-A1 PROCESS FOR THE SYNTHESIS OF 4-(3-SULFONYLPHENYL)-PIPERIDINES NEUROSEARCH SWEDEN AB (SE) 2006-04-20 WO disclosed