SCHEMBL755438

SCHEMBL755438

Cc1cccc(C)c1-c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.43
FFAR1 O14842 2/20 0.42
LRRK2 Q5S007 1/20 0.41
GRIA1 P42261 1/20 0.41
CACNG8 Q8WXS5 1/20 0.41
C1S P09871 3/20 0.41
HTR7 P34969 1/20 0.40
LOX P28300 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
SYK P43405 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL975190 0.82 TSHR (0.61) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL31188685 0.81 ALDH1A1 (0.48) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL5081851 0.80 TSHR (0.59) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL1416443 0.80 TSHR (0.59) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL15509798 0.80 TSHR (0.59) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL27903792 0.80 TSHR (0.59) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL4648550 0.78 ALDH1A1 (0.48) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL4882660 0.77 HTR1A (0.46) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6470695 0.77 ALDH1A1 (0.45) TSHRALDH1A1HSD17B10TDP1LRRK2
SCHEMBL16000652 0.76 TSHR (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011524450-A 2011-09-01 JP claimed
US-20110095109-A1 Process for Producing Polyester Pellets CLARIANT FINANCE (BVI) LIMITED (VG) 2011-04-28 US claimed
EP-2291428-A1 PROCESS FOR PRODUCING POLYESTER PELLETS Clariant Finance (BVI) Limited (VG) 2011-03-09 EP claimed
WO-2009152994-A1 PROCESS FOR PRODUCING POLYESTER PELLETS CLARIANT INTERNATIONAL LTD (CH) 2009-12-23 WO claimed
EP-2431456-A1 New amphiphile polycondensates and use of same in combination with polyester or surfaces containing polyester Polyprec GmbH (DE) 2012-03-21 EP disclosed
US-20110095109-A1 Process for Producing Polyester Pellets CLARIANT FINANCE (BVI) LIMITED (VG) 2011-04-28 US disclosed
EP-2291428-A1 PROCESS FOR PRODUCING POLYESTER PELLETS Clariant Finance (BVI) Limited (VG) 2011-03-09 EP disclosed
WO-2009152994-A1 PROCESS FOR PRODUCING POLYESTER PELLETS CLARIANT INTERNATIONAL LTD (CH) 2009-12-23 WO disclosed