SCHEMBL24522497

SCHEMBL24522497

Cc1ccc(CNc2cccc3cccnc23)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.64
MEN1 O00255 7/20 0.64
HDAC6 Q9UBN7 5/20 0.64
MAPT P10636 5/20 0.64
HDAC3 O15379 2/20 0.64
HDAC1 Q13547 2/20 0.64
HDAC2 Q92769 2/20 0.64
HDAC4 P56524 1/20 0.64
HDAC7 Q8WUI4 1/20 0.64
HDAC10 Q969S8 1/20 0.64
HDAC11 Q96DB2 1/20 0.64
HDAC8 Q9BY41 1/20 0.64
HDAC9 Q9UKV0 1/20 0.64
HDAC5 Q9UQL6 1/20 0.64
NCOR2 Q9Y618 1/20 0.64
GAA P10253 1/20 0.64
RECQL P46063 1/20 0.64
ALDH1A1 P00352 5/20 0.56
BLM P54132 2/20 0.56
L3MBTL1 Q9Y468 2/20 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
SCHEMBL10055011 0.92 HDAC6 (0.72) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL8053546 0.86 HDAC6 (0.64) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL10055012 0.85 HDAC6 (0.67) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL30996044 0.85 KMT2A (0.64) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL30996047 0.85 HDAC6 (0.67) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL30996036 0.85 HDAC6 (0.64) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL30996045 0.84 MAPT (0.62) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL24522458 0.82 HDAC6 (0.69) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL30996046 0.81 HDAC6 (0.63) KMT2AMEN1HDAC6MAPTHDAC3
SCHEMBL18434346 0.81 HDAC6 (0.60) KMT2AMEN1HDAC6MAPTHDAC3

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
EP-3458444-B1 HISTONE DEACETYLASE 6 INHIBITORS AND USE THEREOF UNIV TAIPEI MEDICAL (TW) 2022-06-22 EP disclosed