SCHEMBL10179968

SCHEMBL10179968

C=CS(=O)(=O)c1ccc(C(C)CC)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
TSHR P16473 3/20 0.47
HSD17B10 Q99714 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
XBP1 P17861 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
MDM2 Q00987 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP2C9 P11712 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL10181228 0.81 HDAC4 (0.47) ALDH1A1TSHRHSD17B10NPC1LMNA
SCHEMBL10180338 0.81 ALDH1A1 (0.53) ALDH1A1TSHRHSD17B10NPC1LMNA
SCHEMBL12086454 0.79 MEN1 (0.51) ALDH1A1TSHRHSD17B10LMNASMN1; SMN2
SCHEMBL116856 0.79 MEN1 (0.51) ALDH1A1TSHRHSD17B10LMNASMN1; SMN2
SCHEMBL10031603 0.79 MEN1 (0.51) ALDH1A1TSHRHSD17B10LMNASMN1; SMN2
SCHEMBL10179848 0.79 MEN1 (0.43) ALDH1A1TSHRHSD17B10MEN1KMT2A
SCHEMBL25678903 0.79 ALDH1A1 (0.47) ALDH1A1TSHRHSD17B10LMNAMAPT
Hydrochloric Acid SCHEMBL27560309 0.78 MEN1 (0.50) ALDH1A1TSHRHSD17B10LMNAMEN1
SCHEMBL10179790 0.77 PSIP1 (0.50) ALDH1A1TSHRHSD17B10MAPTMEN1
SCHEMBL10180572 0.77 MEN1 (0.46) ALDH1A1TSHRHSD17B10MEN1KMT2A

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 5 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
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed