SCHEMBL31058043

SCHEMBL31058043

COc1c(Br)cccc1SCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.40
RAB9A P51151 3/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 3/20 0.37
HPGD P15428 3/20 0.37
ALDH1A1 P00352 3/20 0.36
SLC6A4 P31645 1/20 0.36
HTT P42858 1/20 0.36
MCL1 Q07820 1/20 0.36
EGFR P00533 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAOB P27338 2/20 0.36
HTR7 P34969 1/20 0.36
MAOA P21397 1/20 0.36
PTPRC P08575 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35

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
SCHEMBL1770511 1.00 POLB (0.47) POLBL3MBTL1RAB9AKMT2AMEN1
SCHEMBL4930058 0.83 POLB (0.44) POLBL3MBTL1RAB9AKMT2ALMNA
SCHEMBL1118465 0.80 POLB (0.44) POLBL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL31058272 0.80 POLB (0.44) POLBL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL30602334 0.80 ALDH1A1 (0.43) KMT2AMEN1SMN1; SMN2LMNAHPGD
SCHEMBL1118449 0.79 HTR2A (0.43) POLBL3MBTL1RAB9AKMT2ASMN1; SMN2
SCHEMBL4334230 0.79 POLB (0.61) POLBL3MBTL1RAB9AKMT2AMEN1
SCHEMBL30231962 0.78 POLB (0.52) POLBL3MBTL1RAB9AKMT2AMEN1
SCHEMBL1118653 0.78 POLB (0.52) POLBL3MBTL1RAB9AKMT2AMEN1
SCHEMBL1118636 0.78 POLB (0.52) POLBL3MBTL1RAB9AKMT2AMEN1

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
CN-119836416-A KAT6 targeting compounds with ubiquitin ligase binding moiety 普莱鲁德疗法有限公司 2025-04-15 CN disclosed
WO-2024175450-A1 SUBSTITUTED S-ALANINATE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2024-08-29 WO disclosed