SCHEMBL23705489

SCHEMBL23705489

N[C@@H](CCCCNC(=O)O)C(=O)Nc1nc(-c2ccccc2)cs1

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.76
HDAC1 Q13547 11/20 0.57
HDAC3 O15379 10/20 0.57
HDAC4 P56524 10/20 0.57
HDAC7 Q8WUI4 10/20 0.57
HDAC2 Q92769 10/20 0.57
HDAC10 Q969S8 10/20 0.57
HDAC11 Q96DB2 10/20 0.57
HDAC8 Q9BY41 10/20 0.57
HDAC9 Q9UKV0 10/20 0.57
HDAC5 Q9UQL6 10/20 0.57
ELOVL1 Q9BW60 1/20 0.50
MRE11 P49959 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL28529768 1.00 HDAC6 (0.76) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL8069984 0.90 HDAC6 (0.71) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL21224173 0.88 HDAC6 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5481686 0.86 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL5481676 0.86 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL23729529 0.86 HDAC6 (0.66) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL21224178 0.85 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL21224180 0.85 HDAC6 (0.70) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28519113 0.85 HDAC6 (0.61) HDAC6HDAC1HDAC3HDAC4HDAC7
SCHEMBL28528489 0.84 HDAC6 (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4097096-A2 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 EP disclosed
WO-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed