SCHEMBL11242110

SCHEMBL11242110

O=P(O)(OCBr)OCCCO

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 4/20 0.33
LPAR2 Q9HBW0 3/20 0.33
LPAR1 Q92633 2/20 0.33
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
ITPR3 Q14573 1/20 0.31
ITPR1 Q14643 1/20 0.31
TSHR P16473 1/20 0.31
PPARD Q03181 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
SCHEMBL4393949 0.89 LPAR3 (0.39) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL28365879 0.81 LPAR3 (0.43) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL17333317 0.81
SCHEMBL27864078 0.80 LPAR3 (0.34) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL15974123 0.80 LPAR3 (0.48) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL18015062 0.78 ITPR3 (0.41) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL15250606 0.78 LPAR3 (0.47) LPAR3LPAR2LPAR1PPARD
SCHEMBL5850574 0.77 LPAR3 (0.38) LPAR3LPAR2LPAR1CSNK2A2CSNK2B
SCHEMBL23071322 0.76 LPAR3 (0.39) LPAR3LPAR2LPAR1
SCHEMBL16559184 0.76 LPAR3 (0.39) LPAR3LPAR2LPAR1ITPR3ITPR1

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-4345002-A CYCLIC NITROGEN COMPOUND, HYDROXY CONTAINING ORGANO-PHOSPHORUS COMPOUND, AND A PHOSPHORUS CONTAINING ACID GREAT LAKES CHEMICAL CORPORATION (US) 1982-08-17 US disclosed