SCHEMBL25775002

SCHEMBL25775002

Cn1c(CCCCOCc2cccc(Cl)c2)c(C(=O)N2CC[C@H](C(=O)O)C2)c2cnccc21

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 3/20 0.39
▸ CYP4A11 Q02928 3/20 0.39
▸ OXER1 Q8TDS5 7/20 0.36
▸ REN P00797 2/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR5 Q9H228 1/20 0.36
▸ SPR P35270 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35

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
SCHEMBL25772253 0.85 RORC (0.40) OXER1S1PR1S1PR5
SCHEMBL25781205 0.85 CYP4F2 (0.39) CYP4F2CYP4A11S1PR1S1PR5NOTUM
SCHEMBL25781207 0.82 CYP4F2 (0.37) CYP4F2CYP4A11S1PR1S1PR5NOTUM
SCHEMBL25772194 0.82 RORC (0.38) CYP4F2CYP4A11S1PR1S1PR5
SCHEMBL25772307 0.81 CYP4F2 (0.37) CYP4F2CYP4A11S1PR1S1PR5SPR
SCHEMBL25780884 0.81 OXER1 (0.51) OXER1
SCHEMBL25780952 0.81 OXER1 (0.51) OXER1
SCHEMBL25783158 0.80 S1PR1 (0.40) CYP4F2CYP4A11RENS1PR1S1PR5
SCHEMBL25782854 0.79 S1PR1 (0.40) CYP4F2CYP4A11S1PR1S1PR5NOTUM
SCHEMBL25783157 0.78 S1PR1 (0.39) CYP4F2CYP4A11S1PR1S1PR5SPR

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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