SCHEMBL10179703

SCHEMBL10179703

CCC(C)(C)c1ccccc1S(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
HSD11B1 P28845 5/20 0.35
SLC22A12 Q96S37 5/20 0.35
ALDH1A1 P00352 1/20 0.34
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
CYP2D6 P10635 1/20 0.32

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
SCHEMBL10180622 0.85 LMNA (0.37) MEN1KMT2ALMNANPC1MAPK1
SCHEMBL10180608 0.81 HSD11B1 (0.49) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL10180435 0.81 NPC1 (0.41) MEN1KMT2ALMNANPC1MAPK1
SCHEMBL10180163 0.79 LMNA (0.40) MEN1KMT2ALMNANPC1MAPK1
SCHEMBL10181749 0.79 PSIP1 (0.43) MEN1KMT2ALMNANPC1MAPK1
SCHEMBL10180624 0.79 MEN1 (0.36) MEN1KMT2ALMNANPC1MAPK1
SCHEMBL16019355 0.78 MEN1 (0.40) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL10407302 0.78 CA2 (0.45) LMNANPC1MAPK1CASP3RAB9A
SCHEMBL4739143 0.78 MYC (0.41) LMNANPC1MAPK1CASP3RAB9A
Hydrochloric Acid SCHEMBL29289434 0.76 MYC (0.40) LMNANPC1MAPK1CASP3RAB9A

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