SCHEMBL28930600

SCHEMBL28930600

COC(=O)Cn1c2c(c3ccccc31)CCN(C(=O)c1c(F)cccc1Cl)C2

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.44

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
SCHEMBL28678671 0.88 PTGDR2 (0.45) PTGDR2
SCHEMBL29246418 0.86 CYP2C9 (0.50) PTGDR2
SCHEMBL28688193 0.83 PTGDR2 (0.52) PTGDR2
SCHEMBL28688188 0.83 CYP2C9 (0.51) PTGDR2
SCHEMBL29246417 0.82 PTGDR2 (0.54) PTGDR2
SCHEMBL28680236 0.81 PARP1 (0.50) PTGDR2
SCHEMBL28661635 0.79 CYP2C9 (0.51) PTGDR2
SCHEMBL28668268 0.78 PTGDR2 (0.56) PTGDR2
SCHEMBL28675157 0.78 PTGDR2 (0.48) PTGDR2
SCHEMBL28689649 0.77 CYP2C9 (0.65) PTGDR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113845522-A Aminopeptidase N inhibitor and preparation method and application thereof 山东省药学科学院 2021-12-28 — — CN claimed
CN-113845522-B Aminopeptidase N inhibitor and preparation method and application thereof 山东省药学科学院 2024-05-14 — — CN disclosed
CN-113845522-A Aminopeptidase N inhibitor and preparation method and application thereof 山东省药学科学院 2021-12-28 — — CN disclosed
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