SCHEMBL25772192

SCHEMBL25772192

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

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OXER1 Q8TDS5 16/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL25777386 0.92 OXER1 (0.51) OXER1MRGPRX4
SCHEMBL25784387 0.83 OXER1 (0.49) OXER1
SCHEMBL25774022 0.83 OXER1 (0.49) OXER1
SCHEMBL25777267 0.83 OXER1 (0.57) OXER1
SCHEMBL25774732 0.82 OXER1 (0.42) OXER1
SCHEMBL25774077 0.81 OXER1 (0.45) OXER1
SCHEMBL25772252 0.79 OXER1 (0.63) OXER1
SCHEMBL25772251 0.79 OXER1 (0.63) OXER1
SCHEMBL25777802 0.79 OXER1 (0.41) OXER1
SCHEMBL25771317 0.79 OXER1 (0.53) 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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