SCHEMBL8620518

SCHEMBL8620518

CCOP(=O)(OCC)C(CCC(Cc1ccc(C(C)O)cc1)N(C)Cc1ccccc1)P(=O)(OCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
GAA P10253 3/20 0.39
OPRK1 P41145 2/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2A P28223 1/20 0.39
SLC6A4 P31645 1/20 0.39
ADRA1A P35348 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALOX5 P09917 1/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL8615964 0.76 GAA (0.43) POLBGAAALDH1A1LMNAMAPT
SCHEMBL9222544 0.73 GAA (0.41) POLBGAAALDH1A1LMNAMAPT
SCHEMBL5007472 0.70 ALDH1A1 (0.49) POLBGAAOPRK1ADRA2BADRA2C
SCHEMBL8832110 0.69 POLB (0.64) POLBGAAALDH1A1LMNAMAPT
SCHEMBL8624176 0.69 SIGMAR1 (0.47) POLBOPRK1ALDH1A1LMNAMAPT
SCHEMBL9053712 0.67 POLB (0.60) POLBGAAALDH1A1LMNAMAPT
SCHEMBL12876278 0.67 LMNA (0.46) POLBGAAOPRK1ADRA2BADRA2C
SCHEMBL12876205 0.66 POLB (0.50) POLBGAAKCNH2ALDH1A1LMNA
SCHEMBL13685284 0.66 POLB (0.53) POLBGAASLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL29165748 0.65 ADRA2B (0.66) OPRK1ADRA2BADRA2CSLC6A2HTR2A

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-5719303-A USEFUL FOR MEDICALLY TREATING HYPERLIPEMIA EISAI CO., LTD. (JP) 1998-02-17 US disclosed