SCHEMBL8050101

SCHEMBL8050101

FC(F)(F)c1cccc2nnsc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
HSD11B1 P28845 2/20 0.33
AXL P30530 1/20 0.33
PSMB8 P28062 1/20 0.33
BACE1 P56817 1/20 0.33
NOTUM Q6P988 2/20 0.32
MPL P40238 2/20 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
SCHEMBL21718809 0.81 CA2 (0.39) MAPTALDH1A1TDP1
SCHEMBL3701133 0.74 NOTUM (0.33) NOTUMMKNK1MKNK2MALT1
SCHEMBL29561649 0.74
SCHEMBL2838697 0.72 BACE1 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL660265 0.69 KDM4E (0.41) MAPTPOLBAXLMEN1ALDH1A1
SCHEMBL10628456 0.69 HSD11B1 (0.37) MAPTTP53POLBHSD11B1AXL
SCHEMBL10840507 0.69 ALDH1A1 (0.41) HDAC3HDAC4HDAC1HDAC7HDAC2
1,2,3-Benzothia-Diazole-7-Carboxylic Acid SCHEMBL27823931 0.68 ALDH1A1 (0.38) MAPTTP53POLBALDH1A1CYP1A2
SCHEMBL18905972 0.68 THRB (0.31)
SCHEMBL24820021 0.68 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502473-B1 Microbicidal benzo-1,2,3-thiadiazole derivatives NOVARTIS AG (CH) 2000-04-26 EP disclosed
US-5384321-A Benzothiadiazole compounds CIBA-GEIGY CORPORATION (US) 1995-01-24 US disclosed
US-5260423-A Fungicide, viricide or bactericide CIBA-GEIGY CORPORATION (US) 1993-11-09 US disclosed
EP-0502473-A1 Microbicidal benzo-1,2,3-thiadiazole derivatives CIBA-GEIGY AG (CH) 1992-09-09 EP disclosed