SCHEMBL8433962

SCHEMBL8433962

CCCCC(C)COP(=O)(O)OCC(C)CCCC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.47
CYP3A4 P08684 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PLA2G2A P14555 1/20 0.42
SMPD1 P17405 3/20 0.40
LPAR3 Q9UBY5 3/20 0.39
LPAR1 Q92633 2/20 0.39
LPAR2 Q9HBW0 2/20 0.39
LAP3 P28838 1/20 0.38
P2RY10 O00398 3/20 0.38
GPR174 Q9BXC1 3/20 0.38
GPR34 Q9UPC5 2/20 0.38

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
SCHEMBL8433415 0.92 FDPS (0.50) FDPSPLA2G2ASMPD1LPAR3LPAR1
SCHEMBL8436033 0.88 LPAR5 (0.49) FDPSCYP3A4L3MBTL1SMPD1LPAR3
SCHEMBL2473497 0.88 FDPS (0.43) FDPSCYP3A4L3MBTL1PLA2G2ASMPD1
SCHEMBL7614164 0.85 FDPS (0.44) FDPSCYP3A4L3MBTL1SMPD1LPAR3
SCHEMBL11221251 0.84 LMNA (0.44) FDPSCYP3A4PLA2G2A
SCHEMBL140317 0.83 CYP3A4 (0.62) FDPSCYP3A4L3MBTL1SMPD1LPAR3
SCHEMBL12013942 0.82 FDPS (0.39) FDPSCYP3A4L3MBTL1PLA2G2ASMPD1
SCHEMBL29068432 0.81 SGPL1 (0.55) FDPSSMPD1LPAR3LPAR1LPAR2
SCHEMBL8436710 0.81 SGPL1 (0.55) FDPSSMPD1LPAR3LPAR1LPAR2
SCHEMBL28436294 0.80 FDPS (0.37) FDPSCYP3A4L3MBTL1PLA2G2ASMPD1

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
CN-118661232-A Radionuclide generation 比利时核研究中心 2024-09-17 CN disclosed
US-5922654-A TWO OR MORE ORGANOMETALLIC COMPOUNDS WHERE THE METAL IS A TRANSITION METAL OR SEMIMETAL, OR ZINC; FOR EXAMPLE, ZINC DIALKYLDITHIOPHOSPHATE, OR NICKEL DIALKYLDITHIOCARBAMATE; HIGHER LOAD BEARING PROPERTIES, HIGH TEMPERATURE PERFORMANCE NSK LTD. (JP) 1999-07-13 US disclosed