SCHEMBL821433

SCHEMBL821433

COCCCCCC(=O)OCCOCCOC(=O)CCCCCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.52
ALDH1A1 P00352 1/20 0.48
EPHX2 P34913 2/20 0.45
GAA P10253 1/20 0.45
DNM1 Q05193 1/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
GPR84 Q9NQS5 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
PAM P19021 2/20 0.36
KDM4E B2RXH2 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
SCHEMBL17637943 0.95 DGKA (0.50) DGKAALDH1A1EPHX2GAADNM1
SCHEMBL10309810 0.95 DGKA (0.53) DGKAALDH1A1EPHX2GAADNM1
SCHEMBL13085900 0.95 DGKA (0.53) DGKAALDH1A1EPHX2GAADNM1
SCHEMBL12375161 0.95 DGKA (0.57) DGKAALDH1A1EPHX2GAADNM1
SCHEMBL821615 0.93 DGKA (0.52) DGKAALDH1A1EPHX2GAADNM1
SCHEMBL12417283 0.93 DGKA (0.59) DGKAALDH1A1EPHX2DNM1PRSS1
SCHEMBL13751390 0.91 DGKA (0.57) DGKAALDH1A1EPHX2DNM1PRSS1
SCHEMBL822002 0.89 ALDH1A1 (0.52) DGKAALDH1A1GAADNM1PRSS1
SCHEMBL15025025 0.89 DGKA (0.55) DGKAALDH1A1GAADNM1PRSS1
SCHEMBL10001061 0.89 DGKA (0.59) DGKAALDH1A1EPHX2GAADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9587113-B2 Granules comprising bitumen and a thermoplastic polyurethane elastomer, method for its preparation and its uses SOPREMA (FR) 2017-03-07 US disclosed
US-9334338-B2 Water-soluble degradable synthetic vinyl polymers and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2016-05-10 US disclosed
US-9334338-B2 Water-soluble degradable synthetic vinyl polymers and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2016-05-10 US disclosed
US-20150291798-A1 Granules Comprising Bitumen and a Thermoplastic Polyurethane Elastomer, Method for its Preparation and its Uses SOPREMA (FR) 2015-10-15 US disclosed
US-20140213738-A1 POLY(ESTER AMIDE)S AND POLY(ESTER ETHER AMIDE)S WITH ALIPHATIC POLYESTERS, METHOD OF MAKING SAME, AND USES THEREOF CORNELL UNIVERSITY (US) 2014-07-31 US disclosed
US-8772205-B2 Water-soluble degradable synthetic vinyl polymers and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2014-07-08 US disclosed
US-8772205-B2 Water-soluble degradable synthetic vinyl polymers and related methods HALLIBURTON ENERGY SERVICES, INC. (US) 2014-07-08 US disclosed
US-20110269904-A1 Water-Soluble Degradable Synthetic Vinyl Polymers and Related Methods HALLIBURTON ENERGY SERVICES, INC. 2011-11-03 US disclosed
US-20110269651-A1 Water-Soluble Degradable Synthetic Vinyl Polymers and Related Methods HALLIBURTON ENERGY SERVICES, INC. 2011-11-03 US disclosed