SCHEMBL30737331

SCHEMBL30737331

CC(C)(C)OC(=O)NCCCNC(=O)c1cccc2c(Br)cccc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 2/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
AHR P35869 1/20 0.45
KCNA5 P22460 1/20 0.43
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA12 O43570 3/20 0.43
CA9 Q16790 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
NLRP3 Q96P20 1/20 0.42
BRD4 O60885 1/20 0.42
NQO2 P16083 1/20 0.41

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
SCHEMBL30737316 0.86 ALOX5 (0.49) KCNA5CA1CA2CA12CA9
SCHEMBL4059012 0.82 HPGD (0.56) MEN1KMT2AMAPTHTTHPGD
SCHEMBL28027633 0.77 KCNA5 (0.56) MEN1KMT2AHTTKCNA5CA1
SCHEMBL15312850 0.76 NQO2 (0.52) MEN1KMT2AMAPTHTTNPC1
SCHEMBL30313565 0.75 STK17B (0.54) BRD4
SCHEMBL25278729 0.75 HTT (0.51) MEN1KMT2AHTTHPGDNPC1
SCHEMBL31407324 0.75 TP53BP1 (0.70) MEN1KMT2AMAPTHPGDNPC1
SCHEMBL10635530 0.75 KMT2A (0.56) MEN1KMT2AMAPTAHR
SCHEMBL16152246 0.75 SMN1; SMN2 (0.60) MEN1KMT2AMAPTCA1CA2
SCHEMBL22880704 0.74 NPC1 (0.52) MEN1KMT2AHTTNPC1RAB9A

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