SCHEMBL2543391

SCHEMBL2543391

CCCCCP(=O)([O-])[O-].[Cs+].[Cs+]

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 3/20 0.50
LPAR2 Q9HBW0 1/20 0.50
TRPM8 Q7Z2W7 10/20 0.48
FAAH O00519 1/20 0.43

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
SCHEMBL17888835 0.97 LPAR3 (0.54) LPAR3LPAR2TRPM8FAAH
SCHEMBL28486962 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
Lithium Ion SCHEMBL2543702 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL29702383 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL20139441 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL28675308 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL28493992 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL2544026 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
Potassium Ion SCHEMBL2544031 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH
SCHEMBL2545037 0.94 LPAR3 (0.50) LPAR3LPAR2TRPM8FAAH

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
US-8288497-B2 Synthesis of poly-(P-aryleneethynylene)s in neat water under aerobic conditions THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-10-16 US disclosed
US-20110257356-A1 Synthesis of Poly-(P-Aryleneethynylene)s in Neat Water Under Aerobic Conditions THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-10-20 US disclosed
US-20090326150-A1 SYNTHESIS OF POLY-(P-ARYLENEETHYNYLENE)S IN NEAT WATER UNDER AEROBIC CONDIT THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-12-31 US disclosed