SCHEMBL21581671

SCHEMBL21581671

NC(=O)Cc1ccc(-c2noc(C(F)(F)F)n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 16/20 0.72
HDAC6 Q9UBN7 17/20 0.70
HDAC1 Q13547 4/20 0.65
HDAC8 Q9BY41 4/20 0.65
HDAC5 Q9UQL6 1/20 0.56

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
SCHEMBL14645705 0.87 HDAC4 (0.74) HDAC4HDAC6HDAC1HDAC8HDAC5
SCHEMBL26103668 0.86 HDAC6 (0.62) HDAC4HDAC6HDAC1HDAC8HDAC5
SCHEMBL20653962 0.86 HDAC4 (0.64) HDAC4HDAC6HDAC1HDAC8
SCHEMBL20640857 0.86 HDAC4 (0.76) HDAC4HDAC6HDAC1HDAC8
SCHEMBL19071237 0.84 HDAC6 (0.72) HDAC4HDAC6HDAC1HDAC8
SCHEMBL20645594 0.84 HDAC4 (0.62) HDAC4HDAC6HDAC1HDAC8
SCHEMBL14645419 0.84 HDAC4 (1.00) HDAC4HDAC6HDAC1HDAC8
SCHEMBL19861936 0.84 HDAC4 (0.62) HDAC4HDAC6HDAC1HDAC8
SCHEMBL20640861 0.84 HDAC4 (0.69) HDAC4HDAC6HDAC1HDAC8HDAC5
SCHEMBL30882126 0.84 HDAC4 (0.69) HDAC4HDAC6HDAC1HDAC8HDAC5

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-112004813-B Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2024-03-29 CN disclosed
CN-115955916-A Active compound combinations 拜耳公司 2023-04-11 CN disclosed
CN-109415321-B Aromatic sulfonamide derivatives 拜耳制药股份公司 2022-06-17 CN disclosed
WO-2019150219-A9 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2019-11-28 WO disclosed