SCHEMBL6810312

SCHEMBL6810312

CN(C)c1ccccc1N=Nc1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
POLB P06746 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
MAPK1 P28482 2/20 0.52
MAPT P10636 1/20 0.52
CA12 O43570 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
ALPG P10696 1/20 0.42
MYC P01106 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 3/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 2/20 0.39
F2 P00734 3/20 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
SCHEMBL4436535 1.00 MEN1 (0.52) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL8619132 0.86 MEN1 (0.46) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL6677569 0.85 POLB (0.60) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL42642 0.85 CA2 (0.62) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL16322731 0.85 MEN1 (0.71) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL9788043 0.84 POLB (0.58) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL29747008 0.80 MAPK1 (0.53) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL30342247 0.78 TDP1 (0.55) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL187588 0.78 TDP1 (0.55) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL28313589 0.78 TDP1 (0.55) MEN1KMT2APOLBTDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185709-B1 DEVICE AND METHOD FOR STORING INFORMATION NOVEMBER AG MOLEKULARE MEDIZIN (DE) 2004-05-12 EP claimed
EP-3245296-A1 IN VITRO METHOD FOR ESTIMATING IN VIVO PROTEIN DIGESTIBILITY General Mills, Inc. (US) 2017-11-22 EP disclosed
WO-2016115249-A1 IN VITRO METHOD FOR ESTIMATING IN VIVO PROTEIN DIGESTIBILITY GENERAL MILLS, INC. (US) 2016-07-21 WO disclosed