SCHEMBL1706418

SCHEMBL1706418

CN(C)c1ccc(/N=N/c2cccc(/C=C/c3ccccc3S(=O)(=O)O)c2S(=O)(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.46
NPC1 O15118 7/20 0.44
RAB9A P51151 6/20 0.44
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
ALPL P05186 1/20 0.44
ALPI P09923 1/20 0.44
ALPG P10696 1/20 0.44
SENP7 Q9BQF6 4/20 0.42
SENP2 Q9HC62 3/20 0.42
SENP1 Q9P0U3 3/20 0.42
SUMO2 P61956 2/20 0.42
SUMO1 P63165 2/20 0.42
SENP3 Q9H4L4 2/20 0.42
MAPK1 P28482 5/20 0.41
TDP1 Q9NUW8 3/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 1/20 0.41
CA12 O43570 2/20 0.40

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
SCHEMBL1706474 1.00 MYC (0.46) MYCNPC1RAB9AKMT2AMEN1
SCHEMBL333388 0.81 MYC (0.58) MYCNPC1RAB9AKMT2AMEN1
Hydrochloric Acid SCHEMBL28017436 0.80 MYC (0.57) MYCNPC1RAB9AKMT2AMEN1
SCHEMBL2319836 0.74 MYC (0.49) MYCNPC1RAB9AKMT2AMEN1
SCHEMBL2319839 0.74 MYC (0.49) MYCNPC1RAB9AKMT2AMEN1
SCHEMBL8627519 0.74 SENP2 (0.65) NPC1KMT2AMEN1SENP7SENP2
SCHEMBL8627513 0.74 SENP2 (0.65) NPC1KMT2AMEN1SENP7SENP2
SCHEMBL3790423 0.73 SENP2 (0.54) KMT2AMEN1SENP7SENP2SENP1
SCHEMBL5364759 0.72 RAD1 (0.51) SENP7SENP2SENP1SUMO2SUMO1
SCHEMBL29978315 0.72 RAD1 (0.51) SENP7SENP2SENP1SUMO2SUMO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664334-B1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION CRYOLOG S A (FR) 2012-04-18 EP claimed
JP-4834547-B2 2011-12-14 JP claimed
EP-1664334-A1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION Cryolog S.A. (FR) 2006-06-07 EP claimed
WO-2005026383-A1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION CRYOLOG S.A. (FR) 2005-03-24 WO claimed
EP-1664334-B1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION CRYOLOG S A (FR) 2012-04-18 EP disclosed
EP-1664334-A1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION Cryolog S.A. (FR) 2006-06-07 EP disclosed
WO-2005026383-A1 METHOD AND DEVICE FOR DETERMINING IF A PRODUCT IS IN CONDITION FOR USE OR CONSUMPTION CRYOLOG S.A. (FR) 2005-03-24 WO disclosed