SCHEMBL28118020

SCHEMBL28118020

CCCCOCCOCCCCOC(=O)CCCCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.56
PAM P19021 2/20 0.51
AKR1B1 P15121 1/20 0.50
PLA2G4B P0C869 1/20 0.50
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 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
SCHEMBL439160 0.95 DGKA (0.63) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL125146 0.95 DGKA (0.63) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL11409108 0.95 DGKA (0.58) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL2771453 0.95 DGKA (0.63) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL17923147 0.95 DGKA (0.63) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL11209246 0.93 DGKA (0.67) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL7719575 0.93 DGKA (0.67) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL17698430 0.93 DGKA (0.67) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL8086573 0.93 DGKA (0.67) DGKAPAMAKR1B1PLA2G4BGPR84
SCHEMBL28060676 0.93 DGKA (0.67) DGKAPAMAKR1B1PLA2G4BGPR84

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
CN-106574078-A Rubber composition for treads and pneumatic tire 住友橡胶工业株式会社 2017-04-19 CN disclosed
CN-106488950-A Rubber composition and pneumatic tire 住友橡胶工业株式会社 2017-03-08 CN disclosed
CN-106459514-A Tread rubber composition and pneumatic tire 住友橡胶工业株式会社 2017-02-22 CN disclosed