SCHEMBL9387791

SCHEMBL9387791

CON(C)C(=O)C=Cc1cccc(Oc2ccc(O)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.66
▸ PTGS1 P23219 2/20 0.66
▸ PTGS2 P35354 2/20 0.66
▸ BCHE P06276 3/20 0.53
▸ ABCG2 Q9UNQ0 3/20 0.51
▸ MAOB P27338 4/20 0.50
▸ NR1H4 Q96RI1 2/20 0.50
▸ BACE1 P56817 1/20 0.50
▸ ALOX5AP P20292 1/20 0.46
▸ APP P05067 1/20 0.46
▸ EPOR P19235 1/20 0.45
▸ MAOA P21397 1/20 0.45
▸ P4HB P07237 1/20 0.45

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
SCHEMBL9387783 1.00 ALOX5 (0.66) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL9380767 0.91 ALOX5 (0.80) ALOX5PTGS1PTGS2BCHEMAOB
SCHEMBL9380757 0.91 ALOX5 (0.80) ALOX5PTGS1PTGS2BCHEMAOB
SCHEMBL9380196 0.84 CA12 (0.60) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL9380189 0.84 CA12 (0.60) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL23273749 0.83 ALOX5 (0.58) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL6320363 0.83 MAOB (0.62) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL6318820 0.83 MAOB (0.62) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL9380275 0.82 KDM4E (0.59) ALOX5PTGS1PTGS2BCHEABCG2
SCHEMBL9380269 0.82 KDM4E (0.59) ALOX5PTGS1PTGS2BCHEABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0436199-B1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LAB (US) 1994-08-03 — — EP disclosed
US-5120752-A N-(1-(20(3-pyridyloxy)phenyl)cyclopropyl) alkyl-N-hydroxyurea compounds, antiinflammatory agents ABBOTT LABORATORIES (US) 1992-06-09 — — US disclosed
EP-0436199-A1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LABORATORIES (US) 1991-07-10 — — EP disclosed
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