SCHEMBL30737470

SCHEMBL30737470

NCCn1cc(-c2cccc(O)c2)nn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.57
HSD17B1 P14061 3/20 0.54
HSD17B2 P37059 3/20 0.54
HDAC8 Q9BY41 8/20 0.47
HDAC6 Q9UBN7 7/20 0.47
HDAC3 O15379 6/20 0.47
HDAC4 P56524 6/20 0.47
HDAC1 Q13547 6/20 0.47
HDAC7 Q8WUI4 6/20 0.47
HDAC2 Q92769 6/20 0.47
HDAC10 Q969S8 6/20 0.47
HDAC11 Q96DB2 6/20 0.47
HDAC9 Q9UKV0 6/20 0.47
HDAC5 Q9UQL6 6/20 0.47
TEK Q02763 3/20 0.44
IDO1 P14902 1/20 0.43
KDR P35968 1/20 0.43
CD74 P04233 1/20 0.43
MIF P14174 1/20 0.43
DPP4 P27487 1/20 0.43

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
SCHEMBL16169651 0.82 HDAC8 (0.47) ALOX5HDAC8HDAC6HDAC3HDAC4
SCHEMBL18760619 0.82 ALOX5 (0.56) ALOX5HSD17B1HSD17B2HDAC8HDAC6
SCHEMBL30737254 0.82 ALOX5 (0.51) ALOX5HSD17B1HSD17B2HDAC8HDAC6
SCHEMBL19690458 0.81 HDAC8 (0.54) ALOX5HSD17B1HSD17B2HDAC8HDAC6
SCHEMBL12986809 0.78 ALOX5 (0.56) ALOX5HSD17B1HSD17B2HDAC8HDAC6
SCHEMBL30737267 0.78 HDAC3 (0.48) ALOX5HSD17B1HSD17B2HDAC8HDAC6
Water SCHEMBL16279409 0.77 ALOX5 (0.55) ALOX5HSD17B1HSD17B2HDAC8HDAC6
SCHEMBL16068165 0.74 TEK (0.53) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL16169649 0.74 HDAC8 (0.48) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL29050534 0.74 SRC (0.63) ALOX5HSD17B1HSD17B2HDAC8HDAC6

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