SCHEMBL6692098

SCHEMBL6692098

CCCOCCO.CCCOCCOCCO

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
TSHR P16473 2/20 0.65
THRB P10828 1/20 0.64
HTT P42858 1/20 0.64
MAPT P10636 1/20 0.64
MAPK1 P28482 2/20 0.62
ALDH1A1 P00352 3/20 0.58
HSD17B10 Q99714 1/20 0.42
USP2 O75604 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CASP1 P29466 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
SLCO1B1 Q9Y6L6 1/20 0.40
TDP1 Q9NUW8 1/20 0.34
APP P05067 3/20 0.32

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
SCHEMBL55777 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL12253189 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL12595172 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL11913572 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL9639261 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
Triethylene Glycol SCHEMBL55776 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL9640232 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL9639239 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL19000744 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL14495475 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT

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-0018884-B1 PROCESS FOR THE PREPARATION OF TRIS(ETHER AMINES) AND SO OBTAINED TRIS(ETHER AMINES) RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1981-11-04 EP claimed
WO-2004101460-A1 TREATMENT OF EXPANDED PLASTIC PARTICLES FOR LIGTHWEIGHT CONCRETE EPSCEMENT AB (SE) 2004-11-25 WO disclosed