SCHEMBL4272582

SCHEMBL4272582

CC(=O)OOc1cccc(CCCNC(CC(c2ccccc2)c2ccccc2)C(=O)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 2/20 0.42
▸ MTNR1A P48039 2/20 0.42
▸ MTNR1B P49286 2/20 0.42
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HAT1 O14929 2/20 0.37
▸ EP300 Q09472 2/20 0.37
▸ FDFT1 P37268 3/20 0.37
▸ F10 P00742 2/20 0.37
▸ GGT1 P19440 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ AKR1C3 P42330 2/20 0.36
▸ PRSS1 P07477 1/20 0.36

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
SCHEMBL4281834 0.91 RAB9A (0.42) PTGDR2MTNR1AMTNR1BMEN1KMT2A
SCHEMBL4281914 0.87 MTNR1A (0.40) PTGDR2MTNR1AMTNR1BHAT1EP300
SCHEMBL4275416 0.84 PTGDR2 (0.60) PTGDR2
SCHEMBL4275377 0.84 MTNR1A (0.35) MTNR1AMTNR1BMEN1KMT2AGGT1
SCHEMBL4266779 0.81 MTNR1A (0.37) MTNR1AMTNR1BHAT1EP300GGT1
SCHEMBL4268708 0.79 KCNH2 (0.56) PTGDR2MTNR1AMTNR1B
SCHEMBL4273827 0.78 PTGDR2 (0.51) PTGDR2MEN1KMT2A
SCHEMBL4274289 0.78 PTGDR2 (0.53) PTGDR2F10FAAH
SCHEMBL4274216 0.77 PTGDR2 (0.52) PTGDR2KMT2A
SCHEMBL4272589 0.76 PTGDR2 (0.71) PTGDR2MEN1KMT2A

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
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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