SCHEMBL4665182

SCHEMBL4665182

ON=C(c1ccc(OCCCOc2ccc(C(=NO)C(F)(F)F)cc2)cc1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 1/20 0.50
RAB9A P51151 2/20 0.47
TMPRSS2 O15393 2/20 0.46
PRSS1 P07477 3/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
FURIN P09958 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PRMT1 Q99873 3/20 0.41
F2 P00734 2/20 0.41
ST14 Q9Y5Y6 2/20 0.41
PLAU P00749 1/20 0.41
PRMT5 O14744 1/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41

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
SCHEMBL4665179 1.00 GAA (0.50) GAAALOX15HSD17B10ALDH1A1RAB9A
SCHEMBL30219465 0.88 PKM (0.53) GAAALOX15HSD17B10ALDH1A1RAB9A
SCHEMBL7244527 0.88 TP53 (0.62) GAAALOX15HSD17B10RAB9ANPC1
SCHEMBL7246418 0.88 TP53 (0.62) GAAALOX15HSD17B10RAB9ANPC1
SCHEMBL7244525 0.88 TP53 (0.62) GAAALOX15HSD17B10RAB9ANPC1
SCHEMBL7246417 0.88 TP53 (0.62) GAAALOX15HSD17B10RAB9ANPC1
SCHEMBL11991282 0.84 FURIN (0.45) GAAALOX15HSD17B10RAB9ATMPRSS2
SCHEMBL12994641 0.84 FURIN (0.45) GAAALOX15HSD17B10RAB9ATMPRSS2
SCHEMBL6756919 0.83 GAA (0.40) GAAALOX15HSD17B10ALDH1A1RAB9A
SCHEMBL6756922 0.83 GAA (0.40) GAAALOX15HSD17B10ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472576-B1 SULFONATE DERIVATIVES AND THE USE THEROF AS LATENT ACIDS BASF SE (DE) 2013-04-24 EP disclosed
US-20080286693-A1 Sulfonate derivatives and the use thereof as latent acids MATSUMOTO AKIRA 2008-11-20 US disclosed
US-7326511-B2 Sulfonate derivatives and the use thereof as latent acids CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-02-05 US disclosed
US-20050153244-A1 Sulfonate derivatives and the use thereof as latent acids CIBA SPECIALTY CHEMICALS CORP. 2005-07-14 US disclosed
EP-1472576-A2 SULFONATE DERIVATIVES AND THE USE THEROF AS LATENT ACIDS Ciba SC Holding AG (CH) 2004-11-03 EP disclosed
WO-2003067332-A2 SULFONATE DERIVATIVES AND THE USE THEROF AS LATENT ACIDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-08-14 WO disclosed