SCHEMBL406913

SCHEMBL406913

CCC=Cc1ccc(OP(=O)(O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.53
SRC P12931 4/20 0.46
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
INPPL1 O15357 3/20 0.41
INPP5A Q14642 2/20 0.41
GSK3B P49841 1/20 0.38
RELA Q04206 1/20 0.36
F3 P13726 1/20 0.36

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
SCHEMBL21101664 0.77 CA2 (0.40) CA1CA2GSK3B
SCHEMBL6951492 0.77 KDM4E (0.50) BLMSRCCA1CA2CYP2C19
SCHEMBL9019350 0.77 SRC (0.67) BLMSRCCA1CA2INPPL1
SCHEMBL741474 0.75 INPPL1 (0.59) BLMSRCCA1CA2SMN1; SMN2
SCHEMBL329313 0.74 SRC (0.75) BLMSRCCA1CA2CYP2C19
SCHEMBL30340032 0.74 PTGS1 (0.58) BLMSRCCA1CA2CYP2C19
SCHEMBL6790323 0.74 MAPT (0.62) SMN1; SMN2GSK3BF3
SCHEMBL9133021 0.74 MAPT (0.62) SMN1; SMN2GSK3BF3
SCHEMBL556786 0.74 THRB (0.61) BLMSRCCA1CA2SMN1; SMN2
SCHEMBL3514847 0.74 SRC (0.61) BLMSRCCA1CA2SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2392615-B1 POLYOLEFIN RESIN COMPOSITION ADEKA CORP (JP) 2016-12-21 EP disclosed
US-20120022212-A1 POLYOLEFIN RESIN COMPOSITION ADEKA CORPORATION (JP) 2012-01-26 US disclosed
EP-2392615-A1 POLYOLEFIN RESIN COMPOSITION Adeka Corporation (JP) 2011-12-07 EP disclosed
US-20110288216-A1 POLYOLEFIN-BASED RESIN COMPOSITION FOR FOOD, MEDICAL, AND MUNICIPAL WATER PIPE APPLICATIONS ADEKA CORPORATION (JP) 2011-11-24 US disclosed