SCHEMBL17067286

SCHEMBL17067286

CC1(C)CC(NC(=O)c2ccc(Cl)cc2)CC(C)(C)N1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
EZH2 Q15910 8/20 0.70
GLA P06280 1/20 0.64
POLB P06746 1/20 0.62
CYP2C9 P11712 1/20 0.60
L3MBTL1 Q9Y468 2/20 0.59
MAPK1 P28482 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
ATM Q13315 1/20 0.57

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
SCHEMBL169747 0.92 EZH2 (0.80) MEN1KMT2AEZH2GLAPOLB
SCHEMBL8738108 0.92 EZH2 (0.79) MEN1KMT2AEZH2GLAPOLB
SCHEMBL6121185 0.86 EZH2 (0.72) MEN1KMT2AEZH2GLAPOLB
SCHEMBL14679120 0.86 POLB (0.73) MEN1KMT2AEZH2GLAPOLB
SCHEMBL8738667 0.85 EZH2 (0.67) MEN1KMT2AEZH2GLAPOLB
SCHEMBL9002597 0.85 EZH2 (0.70) MEN1KMT2AEZH2GLAPOLB
SCHEMBL13683724 0.85 EZH2 (0.70) MEN1KMT2AEZH2GLAPOLB
SCHEMBL6120701 0.85 EZH2 (0.70) MEN1KMT2AEZH2GLAPOLB
SCHEMBL27636094 0.85 EZH2 (0.70) MEN1KMT2AEZH2GLAPOLB
SCHEMBL2908330 0.84 EZH2 (0.89) MEN1KMT2AEZH2GLAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170298224-A1 Oxygen Scavenging Composition for Plastic Material CLARIANT INTERNATIONAL LTD. (CH) 2017-10-19 US disclosed
US-20170298224-A1 Oxygen Scavenging Composition for Plastic Material CLARIANT INTERNATIONAL LTD. (CH) 2017-10-19 US disclosed
WO-2015135635-A1 OXYGEN SCAVENGING COMPOSITION FOR PLASTIC MATERIAL CLARIANT INTERNATIONAL LTD (CH) 2015-09-17 WO disclosed
EP-2915842-A1 Oxygen scavenging composition for plastic material Clariant International Ltd. (CH) 2015-09-09 EP disclosed