SCHEMBL10852153

SCHEMBL10852153

CCCCCCCCCCCCCCCCCCCCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.81
PTAFR P25105 1/20 0.81
HTR1D P28221 1/20 0.81
HTR2C P28335 1/20 0.81
ADRA1B P35368 1/20 0.81
DRD3 P35462 1/20 0.81
TMEM97 Q5BJF2 1/20 0.81
MAPT P10636 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.64
NR5A2 O00482 1/20 0.64
NR5A1 Q13285 1/20 0.64
LMNA P02545 3/20 0.63
AKT1 P31749 2/20 0.63
MAPK1 P28482 2/20 0.63
MEN1 O00255 2/20 0.63
GMNN O75496 2/20 0.63
BLM P54132 2/20 0.63
KMT2A Q03164 2/20 0.63
NPSR1 Q6W5P4 2/20 0.63
PRKD3 O94806 1/20 0.63

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
SCHEMBL10852722 1.00 ADRA1D (0.81) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10846439 1.00 ADRA1D (0.81) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10847644 1.00 ADRA1D (0.81) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10846630 1.00 ADRA1D (0.81) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10844793 1.00 ADRA1D (0.81) ADRA1DPTAFRHTR1DHTR2CADRA1B
Platelet Activating Factor SCHEMBL2734461 0.89 ADRA1D (1.00) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10920867 0.89 ADRA1D (0.65) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10921755 0.89 ADRA1D (0.65) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10924112 0.89 ADRA1D (0.65) ADRA1DPTAFRHTR1DHTR2CADRA1B
SCHEMBL10917222 0.89 ADRA1D (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0121088-B1 NEW O-ACYL-ALKANEDIOL-PHOSPHOLIPIDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1986-10-01 EP disclosed
US-4610979-A O-acyl-alkanediol-phospholipids and processes for the treatment of asthma A. NATTERMANN & CIE GMBH (DE) 1986-09-09 US disclosed