SCHEMBL10928628

SCHEMBL10928628

CCCCCCCCN(CCCCCCCC)C(=O)C(CCCCCC)P(=O)(O)OC(C)(O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 13/20 0.40
SMPD1 P17405 4/20 0.38
GGPS1 O95749 7/20 0.38
AGTR1 P30556 1/20 0.38
OPRM1 P35372 1/20 0.38
PDE3A Q14432 1/20 0.38
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
LAP3 P28838 1/20 0.36

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
SCHEMBL16697211 0.81 FDPS (0.52) FDPSSMPD1GGPS1MMP1MMP2
SCHEMBL16697100 0.81 LPAR3 (0.42) FDPSSMPD1GGPS1MMP1MMP2
SCHEMBL10928634 0.80 PLA2G4A (0.39) FDPSSMPD1MMP1MMP2MMP3
SCHEMBL11799989 0.78 FDPS (0.52) FDPSSMPD1GGPS1MMP1MMP2
SCHEMBL16697061 0.74 LPAR3 (0.40) FDPSSMPD1GGPS1MMP1MMP2
SCHEMBL16221457 0.67 CA1 (0.52) FDPS
SCHEMBL25414195 0.66 S1PR2 (0.46) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL25914044 0.66 S1PR2 (0.46) FDPSGGPS1AGTR1OPRM1PDE3A
Ethylene SCHEMBL29186282 0.66 GPR84 (0.55)
SCHEMBL8767008 0.66 GPR84 (0.50) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4525289-A NON-CORROSIVE, FRICTION AND WEAR RESISTANT THE PROCTER & GAMBLE COMPANY (US) 1985-06-25 US disclosed
EP-0083124-A1 Alpha phosphonoamides, and lubricant and hydrocarbon fuel compositions containing them THE PROCTER & GAMBLE COMPANY (US) 1983-07-06 EP disclosed