SCHEMBL15580399

SCHEMBL15580399

CNC1CC(C)(C)NC(C)(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RAD52 P43351 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL17376702 0.73 POLB (0.33) ALDH1A1L3MBTL1MAPK1
SCHEMBL3828997 0.71 SMN1; SMN2 (0.34) ALDH1A1TSHRMEN1KMT2AMAPK1
SCHEMBL4419232 0.71 MAPK1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL3134455 0.69 MAPK1 (0.31) ALDH1A1TSHRMAPK1
SCHEMBL27500143 0.68 TSHR (0.33) TSHRMAPK1
SCHEMBL1661781 0.65 MAPK1 (0.34) ALDH1A1TSHRLMNAMAPK1
SCHEMBL10591710 0.63 TP53 (0.31)
SCHEMBL1310223 0.61 RECQL (0.48) ALDH1A1TSHRMEN1LMNAMAPT
SCHEMBL15078148 0.61 ALDH1A1 (0.31) ALDH1A1TSHRLMNA
SCHEMBL11179820 0.61 ALPL (0.34) ALDH1A1TSHRMAPK1

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
US-20150240052-A1 Oxygen Scavenging Plastic Material CLARIANT MASTERBATCHES (ITALIA) SPA (IT) 2015-08-27 US disclosed
WO-2014044366-A1 OXYGEN SCAVENGING PLASTIC MATERIAL CLARIANT INTERNATIONAL LTD (CH) 2014-03-27 WO disclosed
EP-2708574-A1 Oxygen scavenging plastic material Clariant International Ltd. (CH) 2014-03-19 EP disclosed