SCHEMBL14432207

SCHEMBL14432207

COC(=O)C1(NC(=O)Cc2cc(C)c(C)cc2C)CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
ALPL P05186 1/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
THRB P10828 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ANO1 Q5XXA6 1/20 0.33
IDO1 P14902 1/20 0.32

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
SCHEMBL8862748 0.86 L3MBTL1 (0.42) MAPTL3MBTL1ALDH1A1ALPLRAB9A
SCHEMBL14432210 0.86 GAA (0.36) MAPTL3MBTL1ALDH1A1SMN1; SMN2THRB
SCHEMBL8862685 0.86 L3MBTL1 (0.42) MAPTL3MBTL1ALDH1A1ALPLRAB9A
SCHEMBL8862558 0.86 L3MBTL1 (0.42) MAPTL3MBTL1ALDH1A1ALPLRAB9A
SCHEMBL8862996 0.84 L3MBTL1 (0.42) MAPTL3MBTL1ALDH1A1ALPLRAB9A
SCHEMBL7964438 0.84 MEN1 (0.46) MAPTALDH1A1SMN1; SMN2THRB
SCHEMBL2354233 0.84 MAPT (0.38) MAPTL3MBTL1ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL8654496 0.84 ANO1 (0.44) MAPTSMN1; SMN2ANO1
SCHEMBL7949722 0.84 MEN1 (0.46) MAPTALDH1A1SMN1; SMN2THRB
SCHEMBL8650612 0.84 ANO1 (0.44) MAPTSMN1; SMN2ANO1

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
US-7256158-B2 2,4,5,-trisubstituted phenylketo-enols for use as pesticides and herbicides BAYER AG (DE) 2007-08-14 US disclosed
US-7256158-B2 2,4,5,-trisubstituted phenylketo-enols for use as pesticides and herbicides BAYER AG (DE) 2007-08-14 US disclosed