SCHEMBL27771716

SCHEMBL27771716

O=c1ccc(C(c2ccccc2)c2ccccc2)cn1Cc1coc(-c2cccc3c2C=C[N]3)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 5/20 0.34
▸ DRD2 P14416 5/20 0.31
▸ DRD4 P21917 5/20 0.31
▸ DRD3 P35462 5/20 0.31

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
SCHEMBL27850203 0.79 PTGDR2 (0.40) PTGDR2
SCHEMBL3159313 0.79 PTGDR2 (0.34) PTGDR2DRD2DRD4DRD3
SCHEMBL3166424 0.76 PTGDR2 (0.36) PTGDR2DRD2DRD4DRD3
SCHEMBL3165132 0.75 PTGDR2 (0.37) PTGDR2
SCHEMBL4419771 0.73 PTGDR2 (0.36) PTGDR2DRD2DRD4DRD3
SCHEMBL12678732 0.73 POLB (0.37) PTGDR2
SCHEMBL27866952 0.71 PTGDR2 (0.48) PTGDR2
SCHEMBL27792913 0.71 PTGDR2 (0.41) PTGDR2
SCHEMBL27792893 0.60 PTGDR2 (0.45) PTGDR2
SCHEMBL3159412 0.60 PTGDR2 (0.48) PTGDR2DRD2DRD3

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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