SCHEMBL4419630

SCHEMBL4419630

CC(=O)On1ccc2c(CCCn3cc(C(c4ccccc4)c4ccccc4)ccc3=O)cccc21

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 10/20 0.51
▸ PPARG P37231 1/20 0.34
▸ PPARD Q03181 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ MCL1 Q07820 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTR6 P50406 1/20 0.32
▸ CDC25A P30304 1/20 0.32
▸ ADRA1D P25100 2/20 0.32
▸ ADRA1A P35348 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
SCHEMBL4418272 0.90 PTGDR2 (0.51) PTGDR2TP53MCL1MAPTCDC25A
SCHEMBL4415546 0.89 PTGDR2 (0.42) PTGDR2TP53MAPTALDH1A1LMNA
SCHEMBL4416672 0.86 PTGDR2 (0.47) PTGDR2PPARGPPARAMCL1ALDH1A1
SCHEMBL3176967 0.84 PTGDR2 (0.51) PTGDR2PPARGPPARDPPARATP53
SCHEMBL4414924 0.83 PTGDR2 (0.52) PTGDR2MCL1MAPTALDH1A1LMNA
SCHEMBL3164798 0.83 PTGDR2 (0.52) PTGDR2PPARGPPARDPPARAMCL1
SCHEMBL4413606 0.83 PTGDR2 (0.43) PTGDR2
SCHEMBL12678736 0.81 PTGDR2 (0.49) PTGDR2PPARGPPARDPPARAMAPT
SCHEMBL3169190 0.76 PTGDR2 (0.51) PTGDR2TP53MCL1MAPTCDC25A
SCHEMBL3179431 0.75 PTGDR2 (0.52) PTGDR2MCL1ALDH1A1CDC25AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2094662-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS Astellas Pharma Inc. (JP) 2009-09-02 — — EP claimed
WO-2008072784-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS ASTELLAS PHARMA INC. (JP) 2008-06-19 — — WO claimed
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
EP-2094662-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS Astellas Pharma Inc. (JP) 2009-09-02 — — EP disclosed
WO-2008072784-A1 POLYCYCLIC ACID COMPOUNDS USEFUL AS CRTH2 ANTAGONISTS AND ANTIALLERGIC AGENTS ASTELLAS PHARMA INC. (JP) 2008-06-19 — — WO disclosed
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