SCHEMBL2877992

SCHEMBL2877992

COC(=O)c1ccc(CC2CCc3cc(OC)ccc3C2=O)cc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 8/20 0.76
CYP24A1 Q07973 6/20 0.76
CYP19A1 P11511 4/20 0.69
CYP27A1 Q02318 3/20 0.59
ACHE P22303 3/20 0.52
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51

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
SCHEMBL8203668 0.91 CYP26A1 (0.79) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL20809675 0.88 CYP26A1 (0.73) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL7245357 0.85 CYP24A1 (0.80) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL8159828 0.84 CYP26A1 (0.78) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL22105497 0.84 CYP26A1 (0.56) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL5101693 0.83 MTNR1A (0.60)
SCHEMBL6827615 0.81 CYP19A1 (1.00) CYP26A1CYP24A1CYP19A1CYP27A1
SCHEMBL22516995 0.81 ITGB3 (0.55) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL8938852 0.81 CYP24A1 (0.73) CYP26A1CYP24A1CYP19A1CYP27A1ACHE
SCHEMBL4621871 0.80 CYP24A1 (0.68) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975583-B1 AROMATIC AMIDES, THEIR PREPARATION PROCESS AND THEIR USE AS PESTICIDES MERIAL LTD (US) 2010-10-20 EP disclosed
US-6555709-B1 Derivatives of 4-(naphth-2-ylmethyl)-N-(2-methylphenyl) benzamide; storing crops (cotton and rice); insecticides; miticides; nematocides; molluscs; anthelmintics; acarina; textiles; foods HOECHST SCHERING AGREVO S.A. (FR) 2003-04-29 US disclosed
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