SCHEMBL8203668

SCHEMBL8203668

COc1ccc2c(c1)CCC(Cc1ccc(C(=O)O)cc1)C2=O

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 8/20 0.79
CYP24A1 Q07973 6/20 0.79
CYP19A1 P11511 4/20 0.71
CYP27A1 Q02318 3/20 0.61
ACHE P22303 3/20 0.54
ITGB3 P05106 1/20 0.53
ITGA2B P08514 1/20 0.53

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
SCHEMBL2877992 0.91 CYP26A1 (0.76) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL7245357 0.87 CYP24A1 (0.80) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL8159828 0.86 CYP26A1 (0.78) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL6827615 0.83 CYP19A1 (1.00) CYP26A1CYP24A1CYP19A1CYP27A1
SCHEMBL20809677 0.83 CYP26A1 (0.82) CYP26A1CYP24A1CYP19A1ITGB3ITGA2B
SCHEMBL8938852 0.82 CYP24A1 (0.73) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL20809715 0.82 CYP26A1 (0.54) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL4621871 0.82 CYP24A1 (0.68) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL10596034 0.81 CYP24A1 (0.52) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL20809546 0.80 CYP26A1 (0.55) CYP26A1CYP24A1CYP19A1CYP27A1ACHE

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-0975583-A1 AROMATIC AMIDES, THEIR PREPARATION PROCESS AND THEIR USE AS PESTICIDES Hoechst Schering AgrEvo S.A. (FR) 2000-02-02 EP disclosed
WO-1998045252-A1 AROMATIC AMIDES, THEIR PREPARATION PROCESS AND THEIR USE AS PESTICIDES HOECHST SCHERING AGREVO S.A. (FR) 1998-10-15 WO disclosed