SCHEMBL5029484

SCHEMBL5029484

NC(=O)/C=C(\NCCCCCCOP(=O)(O)O)C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 9/20 0.41
LPAR2 Q9HBW0 7/20 0.41
LPAR1 Q92633 5/20 0.41
S1PR1 P21453 6/20 0.39
S1PR3 Q99500 6/20 0.39
S1PR2 O95136 5/20 0.39
S1PR5 Q9H228 4/20 0.39
ENPP2 Q13822 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL5028670 0.88 LPAR2 (0.40) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL5031194 0.82 ENPP2 (0.34) LPAR2LPAR1ENPP2CA2
SCHEMBL4264879 0.74 LPAR3 (0.48) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL4275598 0.74 LPAR3 (0.48) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL6514099 0.74 LPAR3 (0.52) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL19926726 0.74 LPAR3 (0.52) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL19927107 0.74 LPAR3 (0.52) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL11329860 0.73 KDM4E (0.59) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL4264382 0.73 LPAR3 (0.46) LPAR3LPAR2LPAR1S1PR1S1PR3
SCHEMBL907527 0.72 LPAR3 (0.54) LPAR3LPAR2LPAR1S1PR1S1PR3

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
US-7902310-B2 Use as additives for inorganic binding agent suspensions based on cement, lime, gypsum and anhydrite; improve processing and setting processes of building materials produced with these additives by making possible earlier and higher resistances to pressure CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2011-03-08 US disclosed
EP-1883662-B1 COPOLYMERS BASE ON PHOSPHOROUS-CONTAINING MONOMERS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE CONSTR RES & TECH GMBH (DE) 2008-11-05 EP disclosed
US-20080125520-A1 Copolymers Base on Phosphorous-Containing Monomers, Methods for the Production Thereof and Their Use CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2008-05-29 US disclosed
EP-1883662-A1 COPOLYMERS BASE ON PHOSPHOROUS-CONTAINING MONOMERS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE Construction Research and Technology GmbH (DE) 2008-02-06 EP disclosed
WO-2006122793-A1 COPOLYMERS BASE ON PHOSPHOROUS-CONTAINING MONOMERS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2006-11-23 WO disclosed