SCHEMBL8324319

SCHEMBL8324319

O=C(O)/C=C/c1cccc(Cc2nc3ccc(-c4ccccc4)cc3[nH]2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.62
HDAC6 Q9UBN7 4/20 0.62
HDAC8 Q9BY41 3/20 0.62
HDAC3 O15379 2/20 0.62
HDAC4 P56524 2/20 0.62
HDAC7 Q8WUI4 2/20 0.62
HDAC2 Q92769 2/20 0.62
HDAC10 Q969S8 2/20 0.62
HDAC11 Q96DB2 2/20 0.62
HDAC9 Q9UKV0 2/20 0.62
HDAC5 Q9UQL6 2/20 0.62
GAA P10253 3/20 0.50
PKM P14618 3/20 0.50
TSHR P16473 1/20 0.50
KDM4E B2RXH2 2/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
RIPK1 Q13546 1/20 0.46
PRKCZ Q05513 1/20 0.45
IP6K1 Q92551 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
SCHEMBL8320365 0.91 HDAC1 (0.78) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL8326475 0.88 HDAC1 (0.79) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL8324002 0.81 HDAC1 (0.59) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL8319740 0.79 HDAC1 (0.51) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL8318738 0.74 HDAC1 (0.49) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL8322744 0.73 HDAC1 (0.52) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL28357772 0.72 KDM4E (0.63) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL28357770 0.72 KDM4E (0.63) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL414598 0.72 HDAC2 (0.67) HDAC1HDAC6HDAC8HDAC3HDAC4
SCHEMBL414597 0.72 HDAC2 (0.67) HDAC1HDAC6HDAC8HDAC3HDAC4

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-2004063169-A1 HYDROXAMID ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-07-29 WO disclosed