SCHEMBL8449775

SCHEMBL8449775

CCC(Oc1ccc(CO)cc1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.53
PPARA Q07869 13/20 0.53
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 1/20 0.40

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
SCHEMBL2891961 0.85 PPARG (0.67) PPARGPPARASMN1; SMN2
SCHEMBL16242049 0.83 PPARG (0.51) PPARGPPARASMN1; SMN2
SCHEMBL7413009 0.82 PPARG (0.51) PPARGPPARASMN1; SMN2POLB
SCHEMBL8450043 0.82 PPARG (0.51) PPARGPPARASMN1; SMN2POLB
SCHEMBL9856351 0.81 SMN1; SMN2 (0.45) PPARGPPARASMN1; SMN2
SCHEMBL1433697 0.81 ALDH1A1 (0.52) PPARGPPARASMN1; SMN2POLB
SCHEMBL2557160 0.79 ALDH1A3 (0.51) PPARGPPARASMN1; SMN2
SCHEMBL28691529 0.76 BCL9 (0.50)
SCHEMBL30215717 0.76 SMN1; SMN2 (0.41) PPARGPPARASMN1; SMN2
SCHEMBL9080742 0.75 MMP9 (0.58)

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
WO-1999039207-A1 ACID CLEAVABLE PHENOXYALKYL LINKER FOR COMBINATORIAL SYNTHESIS PHARMACOPEIA, INC. (US) 1999-08-05 WO claimed
WO-1999039207-A1 ACID CLEAVABLE PHENOXYALKYL LINKER FOR COMBINATORIAL SYNTHESIS PHARMACOPEIA, INC. (US) 1999-08-05 WO disclosed