SCHEMBL18920719

SCHEMBL18920719

FC(F)(F)c1nc(-c2ccccc2C(Br)Br)no1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 17/20 0.44
HDAC1 Q13547 14/20 0.44
HDAC4 P56524 13/20 0.44
HDAC8 Q9BY41 7/20 0.43
HDAC5 Q9UQL6 3/20 0.43

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
SCHEMBL20528677 0.77 HDAC1 (0.44) HDAC6HDAC1HDAC8HDAC5
SCHEMBL27897967 0.76 CASP3 (0.62) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL17315868 0.76 HDAC6 (0.47) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL19464122 0.72 HDAC1 (0.54) HDAC6HDAC1HDAC8HDAC5
SCHEMBL29362802 0.72 HDAC1 (0.54) HDAC6HDAC1HDAC8HDAC5
SCHEMBL19124280 0.72 HDAC6 (0.47) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL18795777 0.72 HDAC4 (0.54) HDAC6HDAC1HDAC4HDAC8
SCHEMBL10552640 0.72 HDAC4 (0.62) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL2224867 0.72 NPC1 (0.63) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL29242012 0.72 HDAC6 (0.46) HDAC6HDAC1HDAC4HDAC8HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3400223-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES Syngenta Participations AG (CH) 2018-11-14 EP disclosed
EP-3383179-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES Syngenta Participations AG (CH) 2018-10-10 EP disclosed
WO-2018177880-A1 FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2018-10-04 WO disclosed
WO-2017118689-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-07-13 WO disclosed
WO-2017093348-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-08 WO disclosed