SCHEMBL9864884

SCHEMBL9864884

CCSc1sc(C#N)c(O)c1C#N

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 2/20 0.40
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
MAPT P10636 2/20 0.30
HPGD P15428 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
SCHEMBL9865499 0.86 ALDH1A1 (0.47) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9864823 0.83 ALDH1A1 (0.39) GRIA4ALDH1A1MEN1KMT2AMAPT
SCHEMBL9866049 0.79 GRIA4 (0.39) GRIA4ALDH1A1
SCHEMBL9865380 0.79 ALDH1A1 (0.47) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL9864663 0.79 GRIA4 (0.37) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9864520 0.79 GRIA4 (0.37) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9865583 0.77 GRIA4 (0.48) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9865072 0.72 GRIA4 (0.39) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9865496 0.68 GRIA4 (0.39) GRIA4ALDH1A1MEN1KMT2APOLB
SCHEMBL9865083 0.68 KDM4E (0.53) GRIA4ALDH1A1MEN1KMT2AMAPT

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