SCHEMBL31386089

SCHEMBL31386089

CCCCOC(=O)N1CCC(n2cc(C)c3cc(Br)ccc32)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.42
ATM Q13315 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
GAA P10253 2/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
ALOX12 P18054 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.38
USP2 O75604 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL31386146 0.79 CHRM2 (0.40) CHRM2CHRM1SMN1; SMN2GAAHRH2
SCHEMBL30376515 0.78 SMN1; SMN2 (0.42) CHRM2CHRM1SMN1; SMN2GAAHRH2
SCHEMBL30417231 0.78 PTGDR2 (0.43) PTGDR2SMN1; SMN2HRH2HRH1ALDH1A1
SCHEMBL31386252 0.77 SMN1; SMN2 (0.40) CHRM2CHRM1SMN1; SMN2GAAALOX12
SCHEMBL27599197 0.76 L3MBTL1 (0.55) PTGDR2CHRM2CHRM1SMN1; SMN2GAA
SCHEMBL31386170 0.73 PRKCG (0.48)
SCHEMBL30015372 0.73 CHRM2 (0.44) CHRM2CHRM1SMN1; SMN2GAAHRH2
SCHEMBL3306747 0.72 LMNA (0.45) CHRM2CHRM1SMN1; SMN2GAAHRH2
SCHEMBL31385737 0.72 CHRM2 (0.40) CHRM2CHRM1SMN1; SMN2GAAHRH2
SCHEMBL30015386 0.72 L3MBTL1 (0.43) CHRM2CHRM1SMN1; SMN2GAAL3MBTL1

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-4727591-A1 SMARCA2 DEGRADERS AND USES THEREOF Astrazeneca AB (SE) 2026-04-22 EP disclosed
WO-2024256988-A1 SMARCA2 DEGRADERS AND USES THEREOF ASTRAZENECA AB (SE) 2024-12-19 WO disclosed