SCHEMBL30869593

SCHEMBL30869593

BrCCCCCN1c2ccc(Br)cc2Oc2cc(Br)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.41
PIM1 P11309 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
HDAC3 O15379 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
HDAC4 P56524 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 1/20 0.33
TUBB3 Q13509 1/20 0.33
HDAC1 Q13547 1/20 0.33
TUBB2A Q13885 1/20 0.33
TUBB8 Q3ZCM7 1/20 0.33
TUBA3E Q6PEY2 1/20 0.33
TUBA1A Q71U36 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL13308132 0.98 AHR (0.42) AHRPIM1MEN1KMT2ATDP1
SCHEMBL30869472 0.93 AHR (0.44) AHRPIM1MEN1KMT2ATDP1
SCHEMBL28664202 0.93 PIM1 (0.45) AHRPIM1MEN1KMT2ATDP1
SCHEMBL32685459 0.86 AHR (0.47) AHRPIM1MEN1KMT2ATDP1
SCHEMBL3023529 0.86 CNR1 (0.42) AHRPIM1MEN1KMT2ATDP1
SCHEMBL30869728 0.85 PIM1 (0.33) AHRPIM1HDAC3TUBB4ATUBB
SCHEMBL30869692 0.83 PIM1 (0.33) AHRPIM1
SCHEMBL31314370 0.82 ALDH1A1 (0.44) AHRPIM1MEN1KMT2ATDP1
SCHEMBL30869737 0.80 KDM1A (0.51) PIM1MEN1KMT2ATSHR
SCHEMBL16488372 0.80 MEN1 (0.47) AHRPIM1MEN1KMT2ATDP1

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-4583868-A2 DYNAMIN ACTIVATORS Walden Biosciences, Inc. (US) 2025-07-16 EP disclosed
WO-2024054661-A2 DYNAMIN ACTIVATORS WALDEN BIOSCIENCES (US) 2024-03-14 WO disclosed