SCHEMBL30735248

SCHEMBL30735248

Cc1cc(OCCCN2CCCCC2)ccc1Br

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
HRH3 Q9Y5N1 13/20 0.59
ATM Q13315 1/20 0.58
KCNH2 Q12809 1/20 0.55
ACHE P22303 1/20 0.55
RAD52 P43351 1/20 0.55
HRH1 P35367 1/20 0.54
HRH4 Q9H3N8 1/20 0.54
MAOB P27338 1/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
HTT P42858 1/20 0.54

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
SCHEMBL2326590 0.91 KDM4E (0.66) KDM4EHRH3MEN1ALDH1A1KMT2A
SCHEMBL25059606 0.87 KDM4E (0.67) KDM4EL3MBTL1HRH3KCNH2ACHE
SCHEMBL26636800 0.86 HRH3 (0.53) KDM4EL3MBTL1HRH3HRH1MEN1
SCHEMBL14419243 0.84 KDM4E (0.59) KDM4EL3MBTL1HRH3KCNH2MAOB
SCHEMBL1776035 0.83 HRH3 (0.62) KDM4EL3MBTL1HRH3ATMKCNH2
SCHEMBL3573539 0.83 HRH3 (0.59) KDM4EL3MBTL1HRH3ATMKCNH2
SCHEMBL3581300 0.83 KDM4E (0.64) KDM4EL3MBTL1HRH3ATMACHE
SCHEMBL6035058 0.81 MEN1 (0.55) KDM4EHRH3MAOBMEN1ALDH1A1
SCHEMBL10800418 0.80 MAOB (0.61) KDM4EL3MBTL1HRH3ATMKCNH2
SCHEMBL3585716 0.80 HRH3 (0.55) KDM4EL3MBTL1HRH3ATMKCNH2

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-4519259-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS Treeline Biosciences, Inc. (US) 2025-03-12 EP disclosed
WO-2023215482-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS Treeline Biosciences, Inc. (US) 2023-11-09 WO disclosed