SCHEMBL807909

SCHEMBL807909

Bc1ccc([C@H](C)NC(=O)C2CC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACACB O00763 7/20 0.71
HPGD P15428 3/20 0.63
GAA P10253 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
POLB P06746 1/20 0.63
RECQL P46063 1/20 0.62
LMNA P02545 1/20 0.56
ACACA Q13085 1/20 0.52
HTT P42858 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
SCHEMBL15022588 0.85 ACACB (0.73) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL15022586 0.85 ACACB (0.73) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL256318 0.83 ACACB (1.00) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL798361 0.83 POLB (0.88) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL9966795 0.83 POLB (0.88) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL19200906 0.83 ACACB (0.71) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL2184973 0.83 POLB (0.88) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL14314483 0.83 RECQL (0.87) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL15038846 0.83 RECQL (0.87) ACACBHPGDGAASMN1; SMN2POLB
SCHEMBL19884283 0.83 RECQL (0.87) ACACBHPGDGAASMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012035011-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2012-03-22 WO disclosed