SCHEMBL3655249

SCHEMBL3655249

CCc1c[nH]c(C)n1.COC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.35
JAK2 O60674 2/20 0.32
JAK3 P52333 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
BAZ2B Q9UIF8 1/20 0.32
BAZ2A Q9UIF9 1/20 0.32
ALOX15 P16050 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31

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
Acetic Acid SCHEMBL15528121 0.87 NOTUM (0.31) KDM4E
SCHEMBL152067 0.83
SCHEMBL7915030 0.81 NOTUM (0.43) ALDH1A1MEN1KMT2AALOX15
Trifluoroacetic Acid SCHEMBL28185811 0.81 HRH4 (0.34) KDM4E
Bromide SCHEMBL27823644 0.81
Hydrochloric Acid SCHEMBL27681884 0.81
Iodide SCHEMBL632156 0.81
SCHEMBL27799715 0.81
Phosphoric Acid SCHEMBL27696431 0.80 SMN1; SMN2 (0.31)
Sulfuric Acid SCHEMBL27808621 0.80 SMN1; SMN2 (0.31)

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-2203428-A1 METHOD FOR PRODUCING IMIDAZOLIUM SALTS BASF SE (DE) 2010-07-07 EP disclosed
WO-2009040242-A1 METHOD FOR PRODUCING IMIDAZOLIUM SALTS BASF SE (DE) 2009-04-02 WO disclosed