SCHEMBL24969045

SCHEMBL24969045

Oc1ccc(Br)c2c1OCCC2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
DRD2 P14416 2/20 0.33
DRD1 P21728 2/20 0.33
HTR2A P28223 2/20 0.33
DRD3 P35462 2/20 0.33
DRD4 P21917 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL28504448 0.89 MAOA (0.39) MAOAMAOBDRD2DRD1HTR2A
SCHEMBL21752368 0.79 ACHE (0.35)
SCHEMBL25713419 0.78 ACHE (0.34) HTR2A
SCHEMBL27002212 0.78 CYP3A4 (0.34) MAOAMAOBDRD2DRD1HTR2A
SCHEMBL25530815 0.78 ACHE (0.34)
SCHEMBL31039563 0.78 ACHE (0.34)
SCHEMBL21955253 0.77 SLC5A1 (0.30)
SCHEMBL9868328 0.76 SMN1; SMN2 (0.45)
SCHEMBL34464431 0.75 PDE4A (0.31)
SCHEMBL21955272 0.74

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
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed