SCHEMBL7158369

SCHEMBL7158369

C=CCB(c1cccc(C)c1)c1cccc(C)c1CC=C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL7162109 0.76 MAPT (0.34) GAA
SCHEMBL7163485 0.73 KDM4E (0.30) GAA
SCHEMBL7163680 0.70 KDM4E (0.38) TP53TDP1GAA
SCHEMBL1235826 0.70 MAPT (0.44) TP53TDP1GAA
SCHEMBL1159241 0.69 CNR2 (0.38) TDP1
SCHEMBL7160494 0.66 L3MBTL1 (0.36) TP53GAA
Imidazole SCHEMBL9783793 0.64 ALDH1A1 (0.32)
SCHEMBL1158686 0.64 GABRA1 (0.37) TP53GAA
SCHEMBL9003490 0.64 GABRA1 (0.47) GAA
SCHEMBL2321816 0.62 TRPA1 (0.45) GAA

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
EP-0811368-B1 DENTAL PRIMER COMPOSITION AND POLYMERIZATION CATALYST TOKUYAMA CORP (JP) 2003-07-23 EP disclosed
US-5866631-A POLYMERIZABLE MONOMER CONTAINING AN ACIDIC GROUP, WATER, ARYL BORATE AND TRANSITION METAL COMPOUND. TOKUYAMA CORPORATION (JP) 1999-02-02 US disclosed
EP-0811368-A1 DENTAL PRIMER COMPOSITION AND POLYMERIZATION CATALYST TOKUYAMA CORPORATION (JP) 1997-12-10 EP disclosed