SCHEMBL2864987

SCHEMBL2864987

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCC(C)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.69
MAPT P10636 1/20 0.69
DNM1 Q05193 1/20 0.57
LMNA P02545 4/20 0.56
KDM4E B2RXH2 1/20 0.56
DUSP3 P51452 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
PAM P19021 2/20 0.53
ALDH1A1 P00352 1/20 0.53
TSHR P16473 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
LPAR6 P43657 1/20 0.49
LPAR1 Q92633 1/20 0.49
LPAR4 Q99677 1/20 0.49
LPAR5 Q9H1C0 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
LPAR3 Q9UBY5 1/20 0.49

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
SCHEMBL35584 1.00 DGKA (0.69) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL8730928 1.00 DGKA (0.69) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL10512716 0.98 MAPT (0.66) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL10781722 0.93 MAPT (0.59) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL9730363 0.91 DGKA (0.67) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL1197391 0.91 DGKA (0.62) DGKAMAPTMEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL7163141 0.91 MAPT (0.58) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL12076454 0.91 MAPT (0.53) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL29074117 0.90 MAPT (0.65) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL18641642 0.90 MAPT (0.65) DGKAMAPTDNM1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1953180-B1 OXYGEN-ABSORBING RESIN, OXYGEN-ABSORBING RESIN COMPOSITION AND OXYGEN-ABSORBING CONTAINER TOYO SEIKAN KAISHA LTD (JP) 2016-04-06 EP disclosed
US-7696300-B2 Oxygen-absorbing resin, oxygen-absorbing resin composition and oxygen-absorbing container TOYO SEIKAN KAISHA, LTD. (JP) 2010-04-13 US disclosed
US-20100087619-A1 Oxygen-Absorbing Resin, Oxygen-Absorbing Resin Composition and Oxygen-Absorbing Container TOYO SEIKAN KAISHA, LTD. (JP) 2010-04-08 US disclosed
US-20080227912-A1 copolyesters derived from monomers selected from tetrahydrophthalic acid or anhydride, phthalic acid, terephthalic acid and/or isophthalic acid, and 1,4-butanediol and/or 1,6-hexanediol, used for packaging, while effectively inhibiting the generation of any low molecular weight odor component TOYO SEIKAN KAISHA, LTD. (JP) 2008-09-18 US disclosed
EP-1953180-A1 OXYGEN-ABSORBING RESIN, OXYGEN-ABSORBING RESIN COMPOSITION AND OXYGEN-ABSORBING CONTAINER TOYO SEIKAN KAISYA, LTD. (JP) 2008-08-06 EP disclosed