SCHEMBL25772874

SCHEMBL25772874

C[C@H](CC(=O)O)N(C)C(=O)c1c(CCCCOCc2cccc(Cl)c2)n(C)c2ncc(C#N)cc12

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.38
▸ OXER1 Q8TDS5 15/20 0.37
▸ GRM5 P41594 1/20 0.34
▸ FFAR1 O14842 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
SCHEMBL25772924 0.88 MAOB (0.34) MAOBOXER1GRM5
SCHEMBL25781417 0.86 OXER1 (0.43) MAOBOXER1GRM5
SCHEMBL25781504 0.82 EGLN2 (0.35) OXER1GRM5
SCHEMBL25774388 0.81 OXER1 (0.45) MAOBOXER1FFAR1
SCHEMBL25774390 0.81 OXER1 (0.45) MAOBOXER1FFAR1
SCHEMBL25774915 0.80 OXER1 (0.44) OXER1
SCHEMBL25774917 0.80 OXER1 (0.44) OXER1
SCHEMBL25774391 0.80 OXER1 (0.46) OXER1
SCHEMBL25771371 0.80 OXER1 (0.51) OXER1
SCHEMBL25783329 0.80 OXER1 (0.51) OXER1

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-2023115203-A1 OXER1 ANTAGONISTS AND USES THEREOF FAIRHAVEN PHARMACEUTICALS INC. (CA) 2023-06-29 — — WO disclosed
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