SCHEMBL10179856

SCHEMBL10179856

CCC(C)c1cccc(S(=O)(=O)CC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
PSIP1 O75475 2/20 0.50
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
GAA P10253 2/20 0.40
USP2 O75604 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA2 P00918 1/20 0.39
BRD4 O60885 1/20 0.39
HSD11B1 P28845 1/20 0.39
CCR5 P51681 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 3/20 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
SCHEMBL23731660 0.87 HDAC4 (0.59) HDAC4HDAC2HDAC8ALDH1A1HPGD
SCHEMBL10179501 0.87 PSIP1 (0.52) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL18713459 0.85 PSIP1 (0.50) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL16642002 0.85 PSIP1 (0.50) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL10180313 0.85 HDAC4 (0.53) HDAC4HDAC2HDAC8ALDH1A1HPGD
SCHEMBL10180811 0.85 HDAC4 (0.46) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL10180446 0.84 HDAC4 (0.45) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL10180485 0.84 HDAC4 (0.45) HDAC4HDAC2HDAC8PSIP1ALDH1A1
SCHEMBL13898676 0.84 HDAC4 (0.56) HDAC4HDAC2HDAC8ALDH1A1HPGD
SCHEMBL18685337 0.84 PSIP1 (0.48) HDAC4HDAC2HDAC8PSIP1GAA

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