SCHEMBL11239780

SCHEMBL11239780

C=CCP(=O)(CCCCCCCC)CCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 9/20 0.47
LPAR3 Q9UBY5 3/20 0.46
LPAR2 Q9HBW0 1/20 0.46
TSHR P16473 1/20 0.44
FAAH O00519 2/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38

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
SCHEMBL4661661 0.98 TRPM8 (0.48) TRPM8LPAR3LPAR2TSHRFAAH
SCHEMBL646902 0.93 TRPM8 (0.48) TRPM8LPAR3LPAR2TSHRFAAH
SCHEMBL9681978 0.79 LPAR3 (0.52) TRPM8LPAR3LPAR2FAAH
SCHEMBL27722655 0.79 LPAR3 (0.52) TRPM8LPAR3LPAR2FAAH
SCHEMBL9386853 0.79 LPAR3 (0.54) TRPM8LPAR3LPAR2TSHR
SCHEMBL31590811 0.79 LPAR3 (0.54) TRPM8LPAR3LPAR2TSHR
SCHEMBL31590554 0.79 LPAR3 (0.54) TRPM8LPAR3LPAR2TSHR
SCHEMBL31590283 0.79 LPAR3 (0.54) TRPM8LPAR3LPAR2TSHR
SCHEMBL25323220 0.78 LPAR3 (0.62) TRPM8LPAR3LPAR2TSHRFAAH
SCHEMBL13478275 0.78 LPAR3 (0.62) TRPM8LPAR3LPAR2TSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365094-A REACTION OF HALOMETHYL COMPOUND OR POLYMER WITH SECONDARY PHOSPHINE OXIDE SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1982-12-21 US disclosed