SCHEMBL30737158

SCHEMBL30737158

CC(C)(C)OC(=O)NCCn1cc(-c2cccc(O)c2)nn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 9/20 0.45
HDAC4 P56524 9/20 0.45
HDAC1 Q13547 9/20 0.45
HDAC7 Q8WUI4 9/20 0.45
HDAC2 Q92769 9/20 0.45
HDAC10 Q969S8 9/20 0.45
HDAC11 Q96DB2 9/20 0.45
HDAC8 Q9BY41 9/20 0.45
HDAC6 Q9UBN7 9/20 0.45
HDAC9 Q9UKV0 9/20 0.45
HDAC5 Q9UQL6 9/20 0.45
NQO2 P16083 1/20 0.44
ALOX5 P09917 1/20 0.43
CD74 P04233 1/20 0.42
MIF P14174 1/20 0.42
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
P2RY14 Q15391 1/20 0.41
MDM2 Q00987 1/20 0.40
SRC P12931 1/20 0.40

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
SCHEMBL17624403 0.89 HDAC8 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL16775813 0.88 UCHL5 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17273760 0.88 HDAC3 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17618318 0.87 HDAC3 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL30737267 0.84 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18379926 0.78 HDAC3 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15775419 0.76 ALDH1A1 (0.43) IDO1
SCHEMBL15775751 0.75 ALDH1A1 (0.43)
SCHEMBL30737254 0.74 ALOX5 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL16775729 0.74 HDAC8 (0.39) HDAC3HDAC4HDAC1HDAC7HDAC2

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-4543858-A1 BIFUNCTIONAL MOLECULES THAT SELECTIVELY INDUCE DEGRADATION OF EXTRACELLULAR TARGETS IN LYSOSOMES Draupnir Bio ApS (DK) 2025-04-30 EP disclosed
WO-2023247754-A1 BIFUNCTIONAL MOLECULES THAT SELECTIVELY INDUCE DEGRADATION OF EXTRACELLULAR TARGETS IN LYSOSOMES DRAUPNIR BIO APS (DK) 2023-12-28 WO disclosed