SCHEMBL7181575

SCHEMBL7181575

CCCC[P+](CCCC)(CCCC)CCCC.[H+].[O-]P([O-])Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 3/20 0.41
CNR2 P34972 2/20 0.41
DNM1 Q05193 2/20 0.39
CSNK1E P49674 1/20 0.37
KCNH2 Q12809 1/20 0.37
PTGES O14684 2/20 0.36
ALOX5 P09917 2/20 0.36
PPARG P37231 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
TP53 P04637 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
SCHEMBL7177135 0.98 BDKRB2 (0.42) BDKRB2CNR2DNM1CSNK1EKCNH2
Tetrabuthylammonium SCHEMBL7638050 0.81 DNM1 (0.45) CNR2DNM1KCNH2SMN1; SMN2SIGMAR1
Phenol SCHEMBL126078 0.79 DNM1 (0.46) BDKRB2CNR2DNM1SIGMAR1
Tetrabuthylammonium SCHEMBL7635107 0.79 DNM1 (0.46) CNR2DNM1KCNH2SMN1; SMN2SIGMAR1
SCHEMBL7173981 0.78 DNM1 (0.41) BDKRB2CNR2DNM1CSNK1ESIGMAR1
SCHEMBL6903444 0.76 DNM1 (0.43) BDKRB2CNR2DNM1CSNK1ESIGMAR1
SCHEMBL7174016 0.75 CYP1A2 (0.39) SIGMAR1
Benzylphosphonic Acid SCHEMBL7173768 0.75 CNR2 (0.41) BDKRB2CNR2PTGESALOX5PPARG
SCHEMBL15658292 0.74 CNR2 (0.42) CNR2DNM1CSNK1EKCNH2PTGES
Bromide SCHEMBL5086868 0.73 BDKRB2 (0.60) BDKRB2CNR2DNM1CSNK1EKCNH2

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
EP-1275694-A1 AROMATIC POLYCARBONATE COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2003-01-15 EP disclosed