SCHEMBL29627686

SCHEMBL29627686

O=C1c2ccccc2C(=O)N1Cc1ccc(-c2noc(C(F)(F)F)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 16/20 0.62
HDAC1 Q13547 10/20 0.62
HDAC8 Q9BY41 9/20 0.62
MAPT P10636 1/20 0.56
HDAC4 P56524 4/20 0.52
HPGD P15428 1/20 0.52

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
SCHEMBL20529800 1.00 HDAC6 (0.62) HDAC6HDAC1HDAC8MAPTHDAC4
SCHEMBL29966555 0.92 MAPT (0.55) HDAC6HDAC1HDAC8MAPTHDAC4
SCHEMBL20583210 0.82 HDAC6 (0.73) HDAC6HDAC1HDAC8HDAC4
SCHEMBL20528679 0.82 MAPT (0.50) HDAC6HDAC1HDAC8MAPTHPGD
SCHEMBL20583195 0.81 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC4
SCHEMBL20689829 0.80 HDAC6 (0.64) HDAC6HDAC1HDAC8HDAC4
SCHEMBL20583428 0.80 HDAC6 (0.60) HDAC6HDAC1HDAC8HDAC4
SCHEMBL20583534 0.79 HDAC6 (0.59) HDAC6HDAC1HDAC8HDAC4
SCHEMBL21407399 0.79 HDAC6 (0.60) HDAC6HDAC1HDAC8HDAC4
SCHEMBL18920698 0.78 HDAC6 (0.61) HDAC6HDAC1HDAC8HDAC4

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
CN-118047771-A Fungicidal oxadiazoles FMC公司 2024-05-17 CN disclosed
CN-118047729-A Fungicidal oxadiazoles FMC公司 2024-05-17 CN disclosed
EP-4262396-A1 FUNGICIDAL OXADIAZOLES AND THEIR MIXTURES FMC CORPORATION (US) 2023-10-25 EP disclosed
WO-2022133114-A1 FUNGICIDAL OXADIAZOLES AND THEIR MIXTURES FMC CORPORATION (US) 2022-06-23 WO disclosed