SCHEMBL10179924

SCHEMBL10179924

CCc1ccccc1S(=O)(=O)CC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 0.53
PSIP1 O75475 1/20 0.50
HSD11B1 P28845 1/20 0.44
LOXL2 Q9Y4K0 2/20 0.42
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
KMT2A Q03164 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
PLCG1 P19174 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.39
DDR1 Q08345 2/20 0.38
MGLL Q99685 1/20 0.38
ADRA2A P08913 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

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
SCHEMBL4256900 0.88 PLCG1 (0.54) CTSBPSIP1HSD11B1LOXL2GABRA1
SCHEMBL28680071 0.85 PSIP1 (0.59) CTSBPSIP1HSD11B1PLCG1MAPT
SCHEMBL10181520 0.85 PSIP1 (0.45) CTSBPSIP1HSD11B1TAAR1PLCG1
SCHEMBL4598904 0.85 PSIP1 (0.45) CTSBPSIP1LOXL2PLCG1DDR1
SCHEMBL9987989 0.85 PSIP1 (0.45) CTSBPSIP1HSD11B1LOXL2PLCG1
SCHEMBL19617799 0.85 PSIP1 (0.45) CTSBPSIP1HSD11B1GABRA1GABRB2
SCHEMBL780568 0.83 CTSB (0.55) CTSBPSIP1HSD11B1LOXL2GABRA1
Hydrochloric Acid SCHEMBL7370334 0.83 LOXL2 (0.44) CTSBPSIP1HSD11B1LOXL2PLCG1
SCHEMBL4598969 0.81 TAAR1 (0.48) CTSBPSIP1LOXL2TAAR1
SCHEMBL12004765 0.81 PSIP1 (0.42) CTSBPSIP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023083285-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2023-05-19 WO disclosed
US-20130244122-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME ONUKI MASAMICHI (JP) 2013-09-19 US disclosed
US-20120219866-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-30 US disclosed
EP-2475041-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE BATTERY COMPRISING SAME Mitsubishi Chemical Corporation (JP) 2012-07-11 EP disclosed