SCHEMBL8094338

SCHEMBL8094338

CSN(SC)C(=O)Nc1cccc(C)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.64
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
RXFP1 Q9HBX9 1/20 0.54
KCNK3 O14649 1/20 0.50
KCNH2 Q12809 1/20 0.50
KCNK9 Q9NPC2 1/20 0.50
HSP90AA1 P07900 1/20 0.50
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HPGD P15428 1/20 0.50
ALDH1A1 P00352 2/20 0.49
RECQL P46063 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SAE1 Q9UBE0 1/20 0.49
UBA2 Q9UBT2 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.48

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
SCHEMBL8153658 0.81 HSD17B10 (0.65) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL11481489 0.80 HSD17B10 (0.57) HSD17B10KMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL7618599 0.79 HSD17B10 (0.62) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL12133 0.78 HSD17B10 (1.00) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL30703669 0.78 HSD17B10 (1.00) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL9547528 0.77 KMT2A (0.61) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL4416620 0.76 SMN1; SMN2 (0.77) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL21567990 0.76 HSD17B10 (0.74) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL692386 0.76 HSD17B10 (0.74) HSD17B10KMT2AMEN1RXFP1KCNK3
SCHEMBL30762995 0.76 HSD17B10 (0.74) HSD17B10KMT2AMEN1RXFP1KCNK3

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
US-6160194-A Soil decontamination using ferric chelates and peroxide THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 2000-12-12 US disclosed
US-5232484-A Aqueous acid solution; mineralization; absence of large concentrations of organic solvents, chloride and sulfate THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) 1993-08-03 US disclosed