SCHEMBL28176355

SCHEMBL28176355

CCCc1cc(-c2ccc(F)cc2)n(CCc2ccc(C(=O)NO)cc2)n1

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 14/20 0.82
HDAC1 Q13547 13/20 0.82
HDAC3 O15379 12/20 0.82
HDAC4 P56524 12/20 0.82
HDAC7 Q8WUI4 12/20 0.82
HDAC2 Q92769 12/20 0.82
HDAC10 Q969S8 12/20 0.82
HDAC11 Q96DB2 12/20 0.82
HDAC8 Q9BY41 12/20 0.82
HDAC9 Q9UKV0 12/20 0.82
HDAC5 Q9UQL6 12/20 0.82
NCOR2 Q9Y618 12/20 0.82
SMPD1 P17405 2/20 0.56
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 1/20 0.44
MDM2 Q00987 1/20 0.44

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
SCHEMBL28177353 0.92 HDAC6 (0.80) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28525372 0.87 HDAC6 (0.79) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28520186 0.86 HDAC6 (0.81) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28176349 0.83 HDAC6 (0.83) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28177348 0.80 HDAC6 (0.80) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28531912 0.79 HDAC6 (0.80) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28534046 0.75 HDAC1 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL24754549 0.75 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28177365 0.73 HDAC6 (0.81) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28177326 0.73 HDAC6 (0.81) HDAC6HDAC1HDAC3HDAC4HDAC7

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-107445896-B Phenyl hydroxamic acid compound with anti-tumor activity and application thereof 沈阳药科大学 2021-03-05 CN claimed
CN-107445896-A It is a kind of with the benzohydroxamic acid class compound of antitumor activity and its application 沈阳药科大学 2017-12-08 CN claimed
CN-107445896-B Phenyl hydroxamic acid compound with anti-tumor activity and application thereof 沈阳药科大学 2021-03-05 CN disclosed
CN-107445896-A It is a kind of with the benzohydroxamic acid class compound of antitumor activity and its application 沈阳药科大学 2017-12-08 CN disclosed