SCHEMBL10180466

SCHEMBL10180466

CC(C)Cc1cccc(S(=O)(=O)C(F)(F)CF)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.39
HTR2B P41595 2/20 0.39
HTR2C P28335 1/20 0.39
RORC P51449 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SIGMAR1 Q99720 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ADRA2C P18825 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
DRD3 P35462 1/20 0.35
OPRK1 P41145 1/20 0.35
NPC1 O15118 1/20 0.34
TNF P01375 1/20 0.34
RAB9A P51151 1/20 0.34
NOD1 Q9Y239 1/20 0.34
KDM4E B2RXH2 2/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 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
SCHEMBL10182144 0.86 HTR2A (0.41) HTR2AHTR2BHTR2CRORCALDH1A1
SCHEMBL10180374 0.83 LOXL2 (0.40) ALDH1A1LMNAMAPTNPC1TNF
SCHEMBL10180188 0.81 ALDH1A1 (0.49) HTR2AALDH1A1LMNAKDM4ECA2
SCHEMBL10180743 0.81 KAT6A (0.41) RORCLMNANPC1TNFRAB9A
SCHEMBL10180467 0.79 HTR2A (0.41) HTR2AHTR2BHTR2CRORCALDH1A1
SCHEMBL10179562 0.79 KAT6A (0.38) ALDH1A1MAPTKDM4ECA2
SCHEMBL10181301 0.78 TRPV1 (0.41) CA2
SCHEMBL23665873 0.78 NPC1 (0.42) HTR2AHTR2BHTR2CALDH1A1NPC1
SCHEMBL27876500 0.77 HTR6 (0.50) ALDH1A1LMNAMAPTNPC1TNF
SCHEMBL10180810 0.77 HDAC4 (0.44) ALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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