SCHEMBL1825878

SCHEMBL1825878

CCC(C(=O)O)c1ccccc1OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 6/20 0.47
GAA P10253 5/20 0.47
MEN1 O00255 5/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
ALDH1A1 P00352 6/20 0.44
MAPT P10636 5/20 0.44
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DHODH Q02127 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1821345 0.92 MAPT (0.46) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL2835444 0.88 LMNA (0.46) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL8526250 0.85 LMNA (0.50) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL1827857 0.83 LMNA (0.48) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL2833082 0.83 LMNA (0.51) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL1827694 0.81 LMNA (0.49) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL1822253 0.81 ALDH1A1 (0.39) LMNAKMT2AMEN1ALDH1A1HTT
SCHEMBL2831657 0.81 SMN1; SMN2 (0.47) LMNAKMT2AGAAMEN1ALDH1A1
SCHEMBL3583111 0.80 LMNA (0.48) LMNAMAPK1KMT2AGAAMEN1
SCHEMBL1826981 0.79 ALDH1A1 (0.45) LMNAMAPK1KMT2AGAAMEN1

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
EP-1481967-B1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2011-05-04 EP disclosed