SCHEMBL27655459

SCHEMBL27655459

NC(=Nc1nccs1)NOC=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.31
ALDH1A1 P00352 4/20 0.31
HSD17B10 Q99714 3/20 0.31
KMT2A Q03164 3/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
CASP1 P29466 1/20 0.31
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
POLB P06746 1/20 0.31
IDO1 P14902 1/20 0.31
MAPK1 P28482 1/20 0.31
TDO2 P48775 1/20 0.31
GFER P55789 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ERN1 O75460 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL2393252 0.72
SCHEMBL7453863 0.71
Hydrochloric Acid SCHEMBL28834416 0.70 HSD17B10 (0.41) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL10822282 0.69 ALDH1A1 (0.38) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL16571551 0.69
Sulfuric Acid SCHEMBL28785882 0.68 ACP1 (0.37) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL1258975 0.66
SCHEMBL8932378 0.64
SCHEMBL11739433 0.64
SCHEMBL28242378 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1761673-A guanidine derivatives and their use as neuropeptide FF receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2006-04-19 CN disclosed