SCHEMBL4023039

SCHEMBL4023039

CCCCCC(CC)CC.OP(O)(O)=S.OP(O)(O)=S.[Cu]

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
FDPS P14324 4/20 0.45
SMPD1 P17405 3/20 0.44
TDP1 Q9NUW8 1/20 0.43
LAP3 P28838 2/20 0.42
CYP3A4 P08684 2/20 0.41
TSHR P16473 1/20 0.41
CA2 P00918 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LPAR2 Q9HBW0 3/20 0.39
LPAR3 Q9UBY5 3/20 0.39

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
SCHEMBL18279929 0.98 ALDH1A1 (0.50) ALDH1A1LMNAFDPSSMPD1TDP1
SCHEMBL2034569 0.95 ALDH1A1 (0.48) ALDH1A1LMNAFDPSSMPD1TDP1
Dodecylamine SCHEMBL11083172 0.86 DNM1 (0.48) ALDH1A1LMNAFDPSTDP1LAP3
SCHEMBL598336 0.83 ALDH1A1 (0.57) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL28915572 0.80 FDPS (0.40) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL3401826 0.80 LMNA (0.62) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL9204296 0.80 LMNA (0.62) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL8381849 0.80 LMNA (0.62) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL642658 0.80 LMNA (0.62) ALDH1A1LMNAFDPSTDP1CYP3A4
SCHEMBL1769415 0.80 LMNA (0.62) ALDH1A1LMNAFDPSTDP1CYP3A4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1607398-B1 Process for reduced crude sediment in metal salts of hydrocarbyl dithiophosphoric acid CHEVRON ORONITE CO (US) 2009-03-25 EP disclosed
US-5739089-A CONSISTS OF LUBRICATING OIL AND OIL SOLUBLE LIQUID, MIXED ZINC AND COPPER DIHYDROCARBYL DITHIOPHOSPHATE; CORROSION AND OXIDATION RESISTANCE EXXON CHEMICAL PATENTS INC. (US) 1998-04-14 US disclosed
EP-0318218-A2 Dihydrocarbyl dithiophosphates EXXON CHEMICAL PATENTS INC. (US) 1989-05-31 EP disclosed