SCHEMBL31472129

SCHEMBL31472129

Brc1ccc2c(c1)OC=CC2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
BLM P54132 1/20 0.41
AHR P35869 4/20 0.40
CMA1 P23946 1/20 0.35
TDP2 O95551 1/20 0.33
PNMT P11086 3/20 0.32
ASIC3 Q9UHC3 1/20 0.32
ADRA2A P08913 2/20 0.32
METAP1 P53582 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
PARP1 P09874 1/20 0.30
PARP10 Q53GL7 1/20 0.30

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
SCHEMBL1848749 0.84 LMNA (0.41) LMNAMAPTHTTBLMAHR
SCHEMBL276962 0.78
SCHEMBL5644783 0.76 CA1 (0.31) PARP1PARP10
SCHEMBL10426767 0.76 MAPT (0.40) LMNAMAPTTDP1
SCHEMBL547264 0.76 ESR2 (0.46) MAPT
SCHEMBL6917418 0.76 CYP1A2 (0.31) MAPTMETAP1PARP1PARP10
SCHEMBL5537608 0.76
SCHEMBL2011445 0.76
SCHEMBL13911575 0.72 ALDH1A1 (0.34) MAPTHTTTDP1L3MBTL1
SCHEMBL2722706 0.72 PNMT (0.39) PNMT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025026270-A1 BENZO NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2025-02-06 WO disclosed