SCHEMBL31444064

SCHEMBL31444064

O=C1NCCc2ccc(OCc3ccccc3)cc21

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 9/20 0.64
▸ MAOB P27338 9/20 0.64
▸ TOP1 P11387 1/20 0.52
▸ PARP11 Q9NR21 2/20 0.52
▸ PARP1 P09874 4/20 0.50
▸ PARP10 Q53GL7 4/20 0.50
▸ PDPK1 O15530 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.49
▸ F7 P08709 1/20 0.49
▸ F3 P13726 1/20 0.49

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
SCHEMBL4415080 0.89 MAOB (0.64) MAOAMAOBTOP1PARP11PARP1
SCHEMBL5848736 0.82 MAOA (0.68) MAOAMAOBPARP11
SCHEMBL4717674 0.81 MAOB (0.66) MAOAMAOBHRH3
SCHEMBL2524800 0.80 MAOB (0.84) MAOAMAOBTOP1HRH3
SCHEMBL30353268 0.80 MAOB (0.84) MAOAMAOBTOP1HRH3
SCHEMBL30468506 0.80 MAOB (0.57) MAOAMAOBHRH3
SCHEMBL5040852 0.80 MAOB (0.57) MAOAMAOBHRH3
SCHEMBL29051778 0.80 MAOB (0.57) MAOAMAOBHRH3
SCHEMBL3875255 0.80 MAOA (0.68) MAOAMAOBHRH3
SCHEMBL10009086 0.79 MAOA (0.49) MAOAMAOBTOP1PARP11

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-2025096856-A1 COVALENT CEREBLON LIGANDS C4 THERAPEUTICS, INC. (US) 2025-05-08 — — WO disclosed
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