SCHEMBL31300422

SCHEMBL31300422

CCCCCC[Zn]CCCCCC(C)C.OP(O)(=S)S

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.39
LAP3 P28838 2/20 0.37
SMPD1 P17405 3/20 0.36
LPAR2 Q9HBW0 3/20 0.35
LPAR3 Q9UBY5 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
LMNA P02545 1/20 0.34
S1PR2 O95136 5/20 0.34
S1PR1 P21453 5/20 0.34
S1PR3 Q99500 5/20 0.34
S1PR4 O95977 4/20 0.34

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
SCHEMBL27574498 0.97 FDPS (0.35) FDPSLAP3SMPD1LPAR2LPAR3
SCHEMBL11085469 0.93 LMNA (0.34) LMNA
SCHEMBL3096055 0.93 LMNA (0.34) LMNA
SCHEMBL9141939 0.93 LMNA (0.34) LMNA
SCHEMBL15910631 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA
SCHEMBL27511391 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA
SCHEMBL28118699 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA
SCHEMBL3105833 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA
SCHEMBL3100775 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA
SCHEMBL27629368 0.87 LPAR3 (0.43) FDPSLPAR2LPAR3LMNA

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
CN-118994233-A Alkaline dialkyl zinc dithiophosphate additive and preparation method and application thereof 中国石油天然气股份有限公司 2024-11-22 CN disclosed