SCHEMBL4683482

SCHEMBL4683482

Cc1cc(C(=O)O)nn1CCc1cc(Cl)ccc1OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 20/20 0.69
▸ CYP1A2 P05177 1/20 0.63

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
SCHEMBL4684058 0.91 PTGER1 (0.65) PTGER1
SCHEMBL4681630 0.90 PTGER1 (0.65) PTGER1
SCHEMBL4091313 0.90 PTGER1 (0.85) PTGER1CYP1A2
SCHEMBL4681592 0.88 PTGER1 (0.67) PTGER1
SCHEMBL4681009 0.86 PTGER1 (0.75) PTGER1CYP1A2
SCHEMBL4684037 0.86 PTGER1 (0.59) PTGER1CYP1A2
SCHEMBL4685274 0.84 PTGER1 (0.67) PTGER1
SCHEMBL4683984 0.84 PTGER1 (0.85) PTGER1CYP1A2
SCHEMBL4681756 0.84 PTGER1 (0.83) PTGER1
SCHEMBL4091254 0.82 PTGER1 (0.83) PTGER1

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-1675832-B1 HETEROCYCLYL COMPOUNDS GLAXO GROUP LTD (GB) 2008-02-20 — — EP claimed
EP-1675832-B1 HETEROCYCLYL COMPOUNDS GLAXO GROUP LTD (GB) 2008-02-20 — — EP disclosed
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