SCHEMBL31528083

SCHEMBL31528083

CCN1C(=O)Cc2c1ccc(C)c2Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.41
BRD4 O60885 1/20 0.38
ATAD2 Q6PL18 1/20 0.38
ALDH1A1 P00352 4/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 3/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
HBB P68871 1/20 0.33
RORC P51449 1/20 0.33
BMPR1B O00238 1/20 0.33
BMPR1A P36894 1/20 0.33
TGFBR1 P36897 1/20 0.33
ACVRL1 P37023 1/20 0.33
ACVR1 Q04771 1/20 0.33
CYP1A2 P05177 1/20 0.32

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
SCHEMBL31528021 0.88 BMPR1B (0.35) GSK3BALDH1A1GAAMAPTHSD17B10
SCHEMBL31528147 0.83 CRHR1 (0.33) GSK3BMAPTHSD17B10MEN1KMT2A
SCHEMBL31528092 0.82 NR1I2 (0.34) MAPTHSD17B10MEN1KMT2AALOX15
SCHEMBL31528009 0.81 CACNA1S (0.38) MAPTLMNAHTR2AKDM4E
SCHEMBL31528036 0.79 GSK3B (0.40) GSK3BBRD4ATAD2ALDH1A1GAA
SCHEMBL31528090 0.79 GSK3B (0.38) GSK3BBRD4ATAD2ALDH1A1GAA
SCHEMBL21603583 0.78 PKM (0.38) GSK3BBRD4ALDH1A1GAAMAPT
SCHEMBL29778811 0.78 PKM (0.38) GSK3BBRD4ALDH1A1GAAMAPT
SCHEMBL26734406 0.75 GSK3B (0.47) GSK3BBRD4ATAD2ALDH1A1GAA
SCHEMBL31528072 0.74 GSK3B (0.36) GSK3BBRD4ALDH1A1MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094937-A Cannabinoid compounds and uses thereof 2026-05-26 CN claimed
WO-2025078811-A1 CANNABINOID COMPOUNDS AND USES THEREOF JAZZ PHARMACEUTICALS RESEARCH UK LIMITED (GB) 2025-04-17 WO claimed
CN-122094937-A Cannabinoid compounds and uses thereof 2026-05-26 CN disclosed
WO-2025078811-A1 CANNABINOID COMPOUNDS AND USES THEREOF JAZZ PHARMACEUTICALS RESEARCH UK LIMITED (GB) 2025-04-17 WO disclosed