SCHEMBL7859706

SCHEMBL7859706

CCCCCCCCCCCCC(C)(CCCCCCCCCCCC)OP(=O)(O)O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.67
GGPS1 O95749 7/20 0.53
FDPS P14324 10/20 0.52
LPAR3 Q9UBY5 4/20 0.50
LPAR1 Q92633 3/20 0.50
LPAR2 Q9HBW0 2/20 0.48

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
SCHEMBL6553487 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL22403876 1.00 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL17695462 0.96 SMPD1 (0.62) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL27487927 0.96 SMPD1 (0.62) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL27502215 0.94 SMPD1 (0.59) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL29245249 0.92 SMPD1 (0.55) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL5909115 0.88 SMPD1 (0.52) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL9660425 0.84 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL13896287 0.84 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1
SCHEMBL28466128 0.84 SMPD1 (0.67) SMPD1GGPS1FDPSLPAR3LPAR1

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-6299887-B1 USED IN COSMETICS KAO CORPORATION (JP) 2001-10-09 US disclosed