SCHEMBL14339986

SCHEMBL14339986

C=C1CSCC(OC(=O)CCCOP(=O)(O)O)CSC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 4/20 0.32
LPAR2 Q9HBW0 3/20 0.32
LPAR1 Q92633 2/20 0.31
NAAA Q02083 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
SCHEMBL14339990 0.95 LPAR3 (0.36) LPAR3LPAR2LPAR1NAAA
SCHEMBL14339968 0.92
SCHEMBL14339998 0.84 NAAA (0.31) NAAA
SCHEMBL14339989 0.83 PLA2G2A (0.34) NAAA
SCHEMBL14339980 0.81 NAAA (0.32) NAAA
SCHEMBL14339992 0.77 LPAR2 (0.30) LPAR3LPAR2
SCHEMBL10092172 0.76 LMNA (0.36)
SCHEMBL14351243 0.69
SCHEMBL10005437 0.68 NAAA (0.47) NAAA
SCHEMBL13808494 0.67 KDM4E (0.37)

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-20070287792-A1 Dental materials based on ring-opening polymerizable acid monomers IVOCLAR VIVADENT AG (LI) 2007-12-13 US disclosed