SCHEMBL1247153

SCHEMBL1247153

CCOC(=O)C(C)(Cc1ccccc1)C(=O)CBr

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 8/20 0.68
ALDH1A1 P00352 1/20 0.52
RECQL P46063 1/20 0.52
PIN1 Q13526 1/20 0.44
PPID Q08752 1/20 0.40
AKT1 P31749 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL8710582 0.88 MMP8 (0.79) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL27993635 0.87 MMP8 (0.69) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL9526598 0.83 MMP8 (0.73) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL12913254 0.80 MMP8 (0.60) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL28817686 0.78 MMP8 (0.66) MMP8ALDH1A1RECQLPIN1LMNA
SCHEMBL29277123 0.78 ALDH1A1 (0.60) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL1492859 0.78 MMP8 (0.65) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL7362869 0.76 MMP8 (0.59) MMP8ALDH1A1RECQLPIN1LMNA
SCHEMBL10821760 0.76 MMP8 (0.63) MMP8ALDH1A1RECQLPIN1PPID
SCHEMBL12574782 0.76 MMP8 (0.63) MMP8ALDH1A1RECQLPIN1PPID

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-2011014520-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-02-03 WO disclosed