SCHEMBL22666307

SCHEMBL22666307

CCCCCCCC(C)(CCCCCC)OP(=O)(OC(C)(CCCCCC)CCCCCC)c1c[nH]nn1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.36
GGPS1 O95749 6/20 0.33
FDPS P14324 9/20 0.32
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31

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
SCHEMBL25767799 0.85 SMPD1 (0.33) SMPD1GGPS1
SCHEMBL22666306 0.75
SCHEMBL7859704 0.69 SMPD1 (0.50) SMPD1GGPS1FDPSLPAR1LPAR3
SCHEMBL23692666 0.68 S1PR4 (0.32)
SCHEMBL19928210 0.68 S1PR4 (0.32)
SCHEMBL20066540 0.68 S1PR4 (0.32)
SCHEMBL25979519 0.68 CNR2 (0.36)
SCHEMBL18430459 0.68 SMPD1 (0.35) SMPD1GGPS1FDPS
SCHEMBL7859706 0.67 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR1LPAR3
SCHEMBL22403876 0.67 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR1LPAR3

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-20200362337-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2020-11-19 US disclosed