SCHEMBL29784609

SCHEMBL29784609

CC[C@@H]1Cc2c(F)cc(C(=O)NO)cc2CN1CC1CC2CCC(C1)N2C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 11/20 0.43
HDAC1 Q13547 3/20 0.34
HDAC4 P56524 2/20 0.33
HDAC7 Q8WUI4 2/20 0.33
HDAC11 Q96DB2 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
HDAC9 Q9UKV0 2/20 0.33
HDAC5 Q9UQL6 2/20 0.33
HTR3A P46098 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
CACNA1H O95180 1/20 0.30

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
SCHEMBL27229955 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL27229749 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL27229800 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL27229729 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL29784673 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL29784611 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL29784672 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL29784715 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL27232375 1.00 HDAC6 (0.43) HDAC6HDAC1HDAC4HDAC7HDAC11
SCHEMBL27229943 0.89 CHRM3 (0.33) HDAC6HTR3AMEN1KMT2ACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022169985-A1 HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2022-08-11 WO disclosed