SCHEMBL9864685

SCHEMBL9864685

CCCCCC[S+]([O-])c1sc(C#N)c(N)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL9864872 0.83
SCHEMBL9865594 0.83
SCHEMBL9865543 0.77
SCHEMBL9864834 0.77
SCHEMBL9864808 0.75
SCHEMBL9866108 0.75 L3MBTL1 (0.34) MAPTKDM4EHSD17B10
SCHEMBL9826495 0.72 KDM4E (0.33) KDM4EHSD17B10
SCHEMBL9866238 0.71
SCHEMBL9864903 0.69 ALDH1A1 (0.50) MAPTKDM4E
SCHEMBL9864955 0.69 ALDH1A1 (0.41) MAPTKDM4EHSD17B10

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
US-4994485-A Seed and soil fungi, bacteria DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1991-02-19 US disclosed
EP-0234622-B1 NEW THIO COMPOUNDS HAVING FUNGICIDAL ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1990-06-27 EP disclosed
EP-0234622-A1 New thio compounds having fungicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1987-09-02 EP disclosed