SCHEMBL1069053

SCHEMBL1069053

CCOC(=O)/C(Br)=C(/C)Oc1ccccc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
PLIN1 O60240 1/20 0.40
POLB P06746 1/20 0.40
PLIN5 Q00G26 1/20 0.40
ABHD5 Q8WTS1 1/20 0.40
ALDH1A1 P00352 4/20 0.39
GAA P10253 2/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.38
S1PR4 O95977 1/20 0.37
S1PR1 P21453 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CASP1 P29466 1/20 0.36

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
SCHEMBL1069055 1.00 KMT2A (0.40) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL1069073 0.84 FAAH (0.40) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL1069075 0.84 FAAH (0.40) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL1068157 0.79 MAPT (0.38) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL1068159 0.79 MAPT (0.38) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL447320 0.79 MAPT (0.46) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL4991912 0.74 NPSR1 (0.42) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL4991906 0.74 NPSR1 (0.42) KMT2AMEN1MAPTLMNAPLIN1
SCHEMBL1063931 0.73 NLRP3 (0.40) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL1065726 0.73 MAPT (0.40) KMT2AMEN1MAPTLMNAPLIN1

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
EP-2274297-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-19 EP disclosed
WO-2009127546-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 WO disclosed