SCHEMBL8955561

SCHEMBL8955561

CCCCCC/C=C\CCCCCCOP(=O)(O)O[C@H](CC(=O)O)C[N+](C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY10 O00398 1/20 0.51
MAPK1 P28482 4/20 0.49
GMNN O75496 3/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
CYP1A2 P05177 3/20 0.49
MEN1 O00255 2/20 0.49
HSP90AA1 P07900 2/20 0.49
BLM P54132 2/20 0.49
KMT2A Q03164 2/20 0.49
NR1H4 Q96RI1 2/20 0.49
TP53 P04637 1/20 0.49
CYP2C9 P11712 1/20 0.49
TSHR P16473 1/20 0.49
HIF1A Q16665 1/20 0.49
LPAR3 Q9UBY5 2/20 0.49
LPAR1 Q92633 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
SLC6A5 Q9Y345 1/20 0.48

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
SCHEMBL8955569 1.00 P2RY10 (0.51) P2RY10MAPK1GMNNLMNAMAPT
SCHEMBL8955935 0.93 LPAR2 (0.52) P2RY10MAPK1GMNNLMNAMAPT
SCHEMBL8955945 0.93 LPAR2 (0.52) P2RY10MAPK1GMNNLMNAMAPT
SCHEMBL8778530 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
SCHEMBL8955808 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
SCHEMBL8955617 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
SCHEMBL8955625 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
SCHEMBL8778519 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
SCHEMBL8955815 0.93 LMNA (0.56) MAPK1GMNNLMNAMAPTNPSR1
Water SCHEMBL8778591 0.92 LMNA (0.54) MAPK1GMNNLMNAMAPTNPSR1

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
US-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 US disclosed