SCHEMBL5157434

SCHEMBL5157434

CC(C)COC(=O)Nc1nc(NC(=O)OCC(C)C)nc(NC(=O)OCC(C)C)n1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.57
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 3/20 0.57
HSD17B10 Q99714 2/20 0.57
MAPK1 P28482 2/20 0.57
MAPT P10636 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.47
MAOB P27338 1/20 0.44
CSNK2A2 P19784 1/20 0.43
CSNK2A1 P68400 1/20 0.43
LMNA P02545 3/20 0.43
FSHR P23945 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GLS O94925 1/20 0.40
HTT P42858 3/20 0.40
ALOX15 P16050 1/20 0.40
L3MBTL1 Q9Y468 1/20 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
SCHEMBL10616777 0.86 CYP2C9 (0.50) TSHRALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL7411217 0.78 SMN1; SMN2 (0.48) TSHRALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL29763402 0.77 IDH2 (0.49) ALDH1A1KDM4EHSD17B10SMN1; SMN2MAOB
SCHEMBL3363746 0.77 KMT2A (0.53) ALDH1A1KDM4EHSD17B10SMN1; SMN2KMT2A
SCHEMBL20717849 0.77 NPC1 (0.56) TSHRALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL20718426 0.76 TSHR (0.49) TSHRALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL3365548 0.73 SMN1; SMN2 (0.49) TSHRALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL22793395 0.73 NPC1 (0.51) KDM4EMAPTSMN1; SMN2MAOBKMT2A
SCHEMBL20935120 0.73 SMN1; SMN2 (0.47) TSHRALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL22793352 0.73 GAA (0.54) ALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007009581-A1 WATER REDUCIBLE BINDERS FOR CATHODIC ELECTRODEPOSITION COATING COMPOSITIONS CYTEC SURFACE SPECIALTIES AUSTRIA GMBH (AT) 2007-01-25 WO claimed
EP-1743925-A1 Water reducible binders for cathodic electrodeposition coating compositions Cytec Surface Specialties Austria GmbH (AT) 2007-01-17 EP claimed