SCHEMBL2710380

SCHEMBL2710380

CCC(C)(CC(=O)O)OP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
ADRA1A P35348 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
FFAR1 O14842 1/20 0.38
CPT2 P23786 1/20 0.38
CYP2C19 P33261 2/20 0.37
HIF1A Q16665 2/20 0.37
TSHR P16473 2/20 0.37
CYP2D6 P10635 1/20 0.37
SMPD1 P17405 3/20 0.35
KDM4E B2RXH2 1/20 0.33
MVD P53602 1/20 0.32
LPAR3 Q9UBY5 3/20 0.31
LPAR1 Q92633 2/20 0.31
LPAR2 Q9HBW0 2/20 0.31
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
MEN1 O00255 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
SCHEMBL433467 0.85 SMPD1 (0.43) TDP1SMPD1LPAR3LPAR1LPAR2
SCHEMBL31124602 0.82 MVD (0.41) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL621725 0.81 FFAR1 (0.39) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL15321176 0.81 FFAR1 (0.39) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL2710896 0.77 HMGCR (0.42) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL1923665 0.75 SMPD1 (0.46) SMPD1LPAR3LPAR1LPAR2
SCHEMBL18822070 0.75 SMPD1 (0.37) TDP1SMPD1LPAR3LPAR1LPAR2
SCHEMBL9822660 0.74 CYP2D6 (0.35) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL18751328 0.74 HMGCR (0.44) HMGCRCHRM1TBXA2RADRA1ATDP1
SCHEMBL5848596 0.73 MEN1 (0.41) HMGCRCHRM1TBXA2RADRA1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630236-B1 PRODUCTION OF ALKENES BY COMBINED ENZYMATIC CONVERSION OF 3-HYDROXYALKANOIC ACIDS GLOBAL BIOENERGIES (FR) 2019-06-26 EP disclosed
US-20160032326-A1 Production of Alkenes by Combined Enzymatic Conversion of 3-Hydroxyalkanoic Acids GLOBAL BIOENERGIES 2016-02-04 US disclosed
US-9193978-B2 Production of alkenes by combined enzymatic conversion of 3-hydroxyalkanoic acids Scientist of Fortune, S.A. (LU) 2015-11-24 US disclosed
US-20130316425-A1 Production of Alkenes by Combined Enzymatic Conversion of 3-Hydroxyalkanoic Acids Scientist of Fortune, S.A. (LU) 2013-11-28 US disclosed
EP-2630236-A1 PRODUCTION OF ALKENES BY COMBINED ENZYMATIC CONVERSION OF 3-HYDROXYALKANOIC ACIDS Global Bioenergies (FR) 2013-08-28 EP disclosed
WO-2012052427-A1 PRODUCTION OF ALKENES BY COMBINED ENZYMATIC CONVERSION OF 3-HYDROXYALKANOIC ACIDS GLOBAL BIOENERGIES (FR) 2012-04-26 WO disclosed