SCHEMBL2033143

SCHEMBL2033143

CCCCCCC(C)C(C)(C)OCC(CO)(CO)CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
SMPD1 P17405 3/20 0.36
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
FDPS P14324 4/20 0.35
SPHK1 Q9NYA1 2/20 0.35
CYP2D6 P10635 2/20 0.33
GMNN O75496 1/20 0.33
POLB P06746 1/20 0.33
THPO P40225 1/20 0.33
MTOR P42345 1/20 0.33
BLM P54132 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL530415 0.81 LMNA (0.41) LMNASMPD1ALDH1A1HSD17B10MEN1
Ethylene Glycol SCHEMBL2222341 0.77 LMNA (0.44) LMNASMPD1ALDH1A1HSD17B10MEN1
SCHEMBL402782 0.75 OPRM1 (0.41) LMNASMPD1TSHRFDPSSPHK1
SCHEMBL821821 0.75 OPRM1 (0.41) LMNASMPD1TSHRFDPSSPHK1
SCHEMBL6692141 0.74 SMPD1 (0.37) SMPD1FDPSLAP3CA2
SCHEMBL11142939 0.73 OPRM1 (0.42) LMNASMPD1FDPSSPHK1TP53
SCHEMBL11614293 0.73 SMPD1 (0.43) LMNASMPD1FDPSSPHK1CYP2D6
SCHEMBL28382577 0.73 LMNA (0.42) LMNASMPD1ALDH1A1HSD17B10SPHK1
SCHEMBL5473642 0.72 DNM1 (0.34) TSHRFDPSSPHK1CA2
SCHEMBL29197496 0.72 OPRM1 (0.38) LMNASMPD1TSHRFDPSSPHK1

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-7959824-B2 Refrigerating machine oil composition NIPPON OIL CORPORATION (JP) 2011-06-14 US disclosed
US-20070032391-A1 Refrigerating machine oil composition NIPPON OIL CORPORATION (JP) 2007-02-08 US disclosed