SCHEMBL8551973

SCHEMBL8551973

N#C[CH]c1ccsc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.42
ALDH1A1 P00352 6/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
MAPK8 P45983 2/20 0.35
MAPK10 P53779 1/20 0.35
GAA P10253 4/20 0.34
HSD17B10 Q99714 1/20 0.34
PKM P14618 1/20 0.33
RXFP1 Q9HBX9 2/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 4/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
ALOX5 P09917 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
PTK2 Q05397 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
SCHEMBL15651775 0.77 BCAT2 (0.47) BCAT2ALDH1A1MAPTMEN1KMT2A
SCHEMBL31097077 0.76 BCAT2 (0.46) BCAT2ALDH1A1MAPTMEN1KMT2A
SCHEMBL4704140 0.73 BCAT2 (0.43) BCAT2ALDH1A1MAPTMEN1KMT2A
SCHEMBL8551215 0.71 ALDH1A1 (0.48) ALDH1A1MAPTMEN1KMT2AMAPK1
SCHEMBL17152657 0.70 BCAT2 (0.45) BCAT2ALDH1A1MAPTMEN1KMT2A
SCHEMBL3068353 0.67 ALDH1A1 (0.45) BCAT2ALDH1A1MAPTGAAHSD17B10
SCHEMBL56103 0.66
SCHEMBL1366984 0.66
SCHEMBL2889862 0.66 MAPT (0.61) BCAT2ALDH1A1MAPTMEN1KMT2A
SCHEMBL7002263 0.66 MAPK8 (0.49) BCAT2ALDH1A1MAPTMEN1KMT2A

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
EP-0639574-B1 2-aminothiazolecarboxamide derivatives, processes for their preparation and their use for controlling phytopathogenic organisms LUCKY LTD (KR) 1998-06-10 EP disclosed
US-5514643-A FUNGICIDES FOR PLANTS LUCKY LTD. (KR) 1996-05-07 US disclosed
EP-0639574-A1 2-aminothiazolecarboxamide derivatives, processes for their preparation and their use for controlling phytopathogenic organisms LUCKY LTD. (KR) 1995-02-22 EP disclosed