SCHEMBL8993976

SCHEMBL8993976

OCCOCCOCCOc1ccc(OCCOCCOCCO)c(CCOCCO)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
CASP1 P29466 1/20 0.46
KMT2A Q03164 1/20 0.46
SLCO1B3 Q9NPD5 1/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.46
APP P05067 5/20 0.45
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
ALDH2 P05091 1/20 0.39
INPPL1 O15357 1/20 0.38
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL8395857 1.00 MAPK1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8827927 1.00 MAPK1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8827950 1.00 MAPK1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8519048 0.98 ALDH1A1 (0.44) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8396120 0.95 ALDH1A1 (0.40) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8398189 0.94 MAPK1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8399616 0.94 MAPK1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8399232 0.92 ALDH1A1 (0.44) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8399802 0.88 L3MBTL1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2
SCHEMBL8396492 0.88 L3MBTL1 (0.46) MAPK1SMN1; SMN2ALDH1A1MEN1USP2

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-0725051-A2 Copolyesters, molded articles from the same and aromatic triols used for producing the same KURARAY CO., LTD. (JP) 1996-08-07 EP disclosed