SCHEMBL28055334

SCHEMBL28055334

CCC(=O)NN.CCCCc1ccc(O)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.49
KAT8 Q9H7Z6 2/20 0.46
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
IAPP P10997 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
Propionic Acid SCHEMBL27683848 0.84 KAT8 (0.55) SKP2KAT8NPC1HPGDMAPK1
SCHEMBL2475751 0.83 NPC1 (0.62) SKP2KAT8NPC1HPGDMAPK1
Propane SCHEMBL28075119 0.82 NPC1 (0.60) SKP2KAT8NPC1HPGDMAPK1
SCHEMBL28683951 0.82 NPC1 (0.60) SKP2KAT8NPC1HPGDMAPK1
SCHEMBL20882004 0.81 HIF1A (0.52) HPGDHSD17B10MAPTESR1ESR2
SCHEMBL9704230 0.81 ALDH1A1 (0.56) NPC1HPGDRAB9AHSD17B10TRPV1
SCHEMBL4557946 0.78 ESR1 (0.59) SKP2KAT8NPC1HPGDMAPK1
Methyl Phosphonate SCHEMBL27890945 0.78 NPC1 (0.51) SKP2KAT8NPC1HPGDMAPK1
SCHEMBL27353891 0.77 NPC1 (0.55) SKP2KAT8NPC1HPGDMAPK1
SCHEMBL4839074 0.77 KAT8 (0.61) SKP2KAT8NPC1HPGDMAPK1

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
CN-105295354-A New weather-proof stabilizer used for thermoplastic polyurethane RIANLON CORP 2016-02-03 CN disclosed
CN-105295354-A New weather-proof stabilizer used for thermoplastic polyurethane RIANLON CORP 2016-02-03 CN disclosed