SCHEMBL14830815

SCHEMBL14830815

C=C(C)C(=O)OC(COP(=O)([O-])OCC[N+](C)(C)C)OP(=O)([O-])OCC[N+](C)(C)C.C=C(C)C(=O)OCCCCCCOP(=O)([O-])OCC[N+](C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.50
PTAFR P25105 1/20 0.50
HTR1D P28221 1/20 0.50
HTR2C P28335 1/20 0.50
ADRA1B P35368 1/20 0.50
DRD3 P35462 1/20 0.50
TMEM97 Q5BJF2 1/20 0.50
LMNA P02545 2/20 0.47
AKT1 P31749 2/20 0.47
ESR1 P03372 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CDC25A P30304 1/20 0.47
AGTR1 P30556 1/20 0.47
ADRA1A P35348 1/20 0.47
KCNH2 Q12809 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NR5A2 O00482 1/20 0.46
NR5A1 Q13285 1/20 0.46
PRKD3 O94806 1/20 0.44

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
SCHEMBL428693 0.91 SMN1; SMN2 (0.52) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL2118062 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL2117527 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL2122717 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL2120096 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL223046 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL1260875 0.88 LMNA (0.60) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL423161 0.86 LMNA (0.57) ADRA1DPTAFRHTR1DHTR2CADRA1B
Phosphoric Acid SCHEMBL2035967 0.84 LMNA (0.55) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL1261204 0.84 LMNA (0.54) ADRA1DPTAFRHTR1DHTR2CADRA1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140248475-A1 BIOCOMPATIBLE MEMBER AND METHOD FOR FORMING BIOCOMPATIBLE MEMBER FUJIFILM CORPORATION (JP) 2014-09-04 US disclosed
EP-2760489-A1 BIOCOMPATIBLE MEMBER AND METHOD FOR FORMING BIOCOMPATIBLE MEMBER Fujifilm Corporation (JP) 2014-08-06 EP disclosed
WO-2013047395-A1 BIOCOMPATIBLE MEMBER AND METHOD FOR FORMING BIOCOMPATIBLE MEMBER FUJIFILM CORPORATION (JP) 2013-04-04 WO disclosed