SCHEMBL9826317

SCHEMBL9826317

CCCS(=O)(=O)c1nc(N)c(C#N)s1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 2/20 0.32
KMT2A Q03164 3/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.31
RECQL P46063 1/20 0.31
MEN1 O00255 1/20 0.30

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
SCHEMBL9827563 0.91 KDM4E (0.38) ALDH1A1KDM4EHSD17B10KMT2APOLB
SCHEMBL9826021 0.89 KDM4E (0.33) ALDH1A1KDM4EHSD17B10RXFP1MAPK1
SCHEMBL9826175 0.88 KDM4E (0.34) ALDH1A1KDM4EHSD17B10KMT2APOLB
SCHEMBL9827239 0.81 ALDH1A1 (0.40) LOXL2ALDH1A1RXFP1KMT2APOLB
SCHEMBL1514052 0.78 SMN1; SMN2 (0.33) ALDH1A1KDM4E
SCHEMBL27917730 0.74 KDM4E (0.31) ALDH1A1KDM4ERXFP1
SCHEMBL9827086 0.73 ALDH1A1 (0.39) ALDH1A1KDM4EHSD17B10KMT2APOLB
SCHEMBL10569137 0.71 CCR4 (0.34) KDM4EPOLB
SCHEMBL11388959 0.69 LOXL2 (0.34) LOXL2ALDH1A1KDM4EKMT2APOLB
SCHEMBL9827817 0.69 ALDH1A1 (0.43) ALDH1A1RXFP1KMT2AMEN1

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-0301613-B1 THIAZOLE COMPOUNDS HAVING FUNGICIDAL ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1991-07-10 EP disclosed
US-4889863-A NONPHYTOTOXIC; SEEDS, SOILS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1989-12-26 US disclosed
EP-0301613-A1 Thiazole compounds having fungicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1989-02-01 EP disclosed