SCHEMBL6940703

SCHEMBL6940703

CCCCCCC(=O)/C=C/c1cccc(O)c1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.70
▸ IAPP P10997 3/20 0.61
▸ HTR1A P08908 1/20 0.54
▸ P4HB P07237 1/20 0.53
▸ TOP2A P11388 2/20 0.51
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ HSP90AA1 P07900 1/20 0.50
▸ ALOX5 P09917 1/20 0.48

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
SCHEMBL6940708 1.00 APP (0.70) APPIAPPHTR1AP4HBTOP2A
SCHEMBL7316471 0.83 APP (0.59) APPIAPPHTR1ATOP2AMAOA
SCHEMBL7316473 0.83 APP (0.59) APPIAPPHTR1ATOP2AMAOA
SCHEMBL547240 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL9019324 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL3398186 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL157815 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL17746768 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL10954039 0.83 APP (0.66) APPIAPPHTR1AHSP90AA1
SCHEMBL8847657 0.83 APP (0.66) APPIAPPHTR1ATOP2A

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-1050528-B1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds DOW AGROSCIENCES LLC (US) 2003-01-22 — — EP disclosed
US-6335367-B1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds DOW AGROSCIENCES LLC 2002-01-01 — — US disclosed
EP-1050528-A1 Fungicidal and insecticidal benzyloxy cyclopropyl substituted aromatic compounds ROHM AND HAAS COMPANY (US) 2000-11-08 — — EP disclosed
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