SCHEMBL31366939

SCHEMBL31366939

COCCCC(=O)OCCOCCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.47
DGKA P23743 1/20 0.46
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MGLL Q99685 1/20 0.41
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 4/20 0.38
MAPK1 P28482 2/20 0.37
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
DNM1 Q05193 1/20 0.35
BLM P54132 1/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CASP1 P29466 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL821615 0.93 DGKA (0.52) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL21659321 0.93 EPHX2 (0.50) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL407271 0.88 MGLL (0.49) EPHX2DGKAMEN1KMT2AMGLL
2-Ethoxyethanol SCHEMBL6685782 0.88 ALDH1A1 (0.47) EPHX2DGKAMGLLALDH1A1THRB
SCHEMBL9903542 0.86 ALDH1A1 (0.50) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL11579370 0.86 DGKA (0.54) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL207583 0.86 DGKA (0.54) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL2922616 0.86 DGKA (0.54) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL6417620 0.86 DGKA (0.54) EPHX2DGKAMEN1KMT2AMGLL
SCHEMBL2845276 0.86 MEN1 (0.50) EPHX2DGKAMEN1KMT2AMGLL

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
CN-119421934-A Inorganic microparticle dispersion 住友化学株式会社 2025-02-11 CN disclosed