SCHEMBL27792913

SCHEMBL27792913

O=c1ccc(C(c2ccccc2)c2ccccc2)cn1CCNc1cccc2c1C=C[N]2

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 9/20 0.41
▸ EPHX2 P34913 1/20 0.32

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
SCHEMBL27866952 0.80 PTGDR2 (0.48) PTGDR2
SCHEMBL27850203 0.79 PTGDR2 (0.40) PTGDR2
SCHEMBL28797129 0.75 PTGDR2 (0.37) PTGDR2
SCHEMBL3159520 0.71 PTGDR2 (0.46) PTGDR2
SCHEMBL27771716 0.71 PTGDR2 (0.34) PTGDR2
SCHEMBL3164878 0.70 PTGDR2 (0.53) PTGDR2EPHX2
SCHEMBL4413606 0.68 PTGDR2 (0.43) PTGDR2EPHX2
SCHEMBL16493911 0.67 PTGDR2 (0.52) PTGDR2EPHX2
SCHEMBL3165962 0.67 PTGDR2 (0.52) PTGDR2EPHX2
SCHEMBL3174285 0.67 PTGDR2 (0.52) PTGDR2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102442941-A Polycyclic acid compounds useful as crth2 antagonists and antiallergic agents ASTELLAS PHARMA INC 2012-05-09 — — CN disclosed
CN-101636386-A Polycyclic acid compounds useful as CRTH2 antagonists and antiallergic agents ASTELLAS PHARMA INC 2010-01-27 — — CN disclosed
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