SCHEMBL31359541

SCHEMBL31359541

OCc1cc(OCc2ccccc2)c2ccoc2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.47
MAOA P21397 1/20 0.46
KCNA3 P22001 5/20 0.44
LIPE Q05469 1/20 0.42
KCNA5 P22460 4/20 0.42
KCNA1 Q09470 2/20 0.42
PIN1 Q13526 1/20 0.41
KCNA2 P16389 1/20 0.39
SLC2A1 P11166 1/20 0.39

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
SCHEMBL28905201 0.79 KCNA3 (0.49) MAOBMAOAKCNA3PIN1
SCHEMBL29846180 0.79 KCNA3 (0.49) MAOBMAOAKCNA3PIN1
SCHEMBL31359523 0.78 MAOB (0.45) MAOBMAOAKCNA3LIPEKCNA5
SCHEMBL31359542 0.78 MAOB (0.48) MAOBMAOAKCNA3KCNA5KCNA1
SCHEMBL31359539 0.78 MAOB (0.48) MAOBMAOAKCNA3KCNA5KCNA1
SCHEMBL3372411 0.77 MAOB (0.64) MAOBMAOAKCNA3LIPE
SCHEMBL31359519 0.77 HPGD (0.55) MAOBMAOAKCNA3
SCHEMBL4431406 0.76 MRGPRX4 (0.50) LIPE
SCHEMBL4420078 0.75 LIPE (0.47) LIPE
SCHEMBL31528156 0.73 RAB9A (0.50) MAOBLIPE

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-121586712-A Novel compounds 豪夫迈·罗氏有限公司 2026-02-27 CN disclosed
WO-2025026882-A1 NOVEL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2025-02-06 WO disclosed