SCHEMBL11239280

SCHEMBL11239280

O=C(O)c1ccccc1C(=O)OCCOCCOCCOC(=O)c1ccccc1C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.62
TSHR P16473 8/20 0.61
KMT2A Q03164 2/20 0.58
PTK2B Q14289 1/20 0.58
TDP1 Q9NUW8 5/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
ALOX15 P16050 1/20 0.54
CYP3A4 P08684 4/20 0.53
MAPK1 P28482 3/20 0.53
TP53 P04637 2/20 0.53
NPC1 O15118 3/20 0.51
HPGD P15428 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 2/20 0.51
LMNA P02545 1/20 0.51
GLA P06280 1/20 0.51
HIF1A Q16665 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50

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
Ethylene SCHEMBL11346482 0.96 ALDH1A1 (0.59) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL3302489 0.94 ALDH1A1 (0.69) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL185056 0.93 ALDH1A1 (0.56) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL2458008 0.93 ALDH1A1 (0.56) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL29668009 0.93 ALDH1A1 (0.56) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL8578853 0.93 ALDH1A1 (0.56) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL28492073 0.92 ALDH1A1 (0.67) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL28577680 0.92 ALDH1A1 (0.54) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL31541130 0.92 TSHR (0.77) ALDH1A1TSHRKMT2APTK2BTDP1
SCHEMBL28902269 0.92 ALDH1A1 (0.54) ALDH1A1TSHRKMT2APTK2BTDP1

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
US-4347984-A Electrostatic spray coating apparatus PPG INDUSTRIES, INC. (US) 1982-09-07 US disclosed