SCHEMBL10180381

SCHEMBL10180381

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
ALDH1A1 P00352 5/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 3/20 0.47
MAPK1 P28482 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 2/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
XBP1 P17861 1/20 0.47
HTT P42858 1/20 0.47
MDM2 Q00987 1/20 0.47
CASP3 P42574 1/20 0.40
ATM Q13315 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
HPGD P15428 2/20 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
SCHEMBL11331008 0.86 SHBG (0.48) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL11331013 0.82 CNR2 (0.46) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL7030067 0.81 ALDH1A1 (0.56) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10181117 0.80 NPC1 (0.43) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL4733508 0.79 LMNA (0.45) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10179464 0.79 PNMT (0.38) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10181733 0.79 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTLMNA
Hydrochloric Acid SCHEMBL28138846 0.78 LMNA (0.43) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10180558 0.77 PSIP1 (0.50) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10181070 0.77 ENPP2 (0.45) NPC1RAB9AALDH1A1MAPTLMNA

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