SCHEMBL11526769

SCHEMBL11526769

CCCCC(CC)COP(=O)(Cc1c(C)cc(C(C)(C)C)c(O)c1C)OCC(CC)CCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HMGCR P04035 3/20 0.35
LMNA P02545 4/20 0.35
TSHR P16473 4/20 0.35
HTR1A P08908 2/20 0.35
ADRA2A P08913 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
ADRA1D P25100 1/20 0.35
HTR1D P28221 1/20 0.35

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
SCHEMBL9659019 0.83 CYP3A4 (0.47) CYP3A4L3MBTL1HMGCRLMNATSHR
SCHEMBL11529863 0.81 LMNA (0.38) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11528379 0.81 LMNA (0.38) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11526814 0.81 LMNA (0.38) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11527969 0.81 LMNA (0.38) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11803366 0.80 HMGCR (0.46) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11478273 0.78 CYP3A4 (0.50) CYP3A4L3MBTL1LMNATSHRHTR1A
SCHEMBL6228436 0.77 CYP3A4 (0.47) CYP3A4L3MBTL1HMGCRLMNATSHR
SCHEMBL11527505 0.76 LMNA (0.34) CYP3A4HMGCRLMNATSHRHTR1A
SCHEMBL11533049 0.75 CYP2C19 (0.44) CYP3A4HMGCRLMNATSHRHTR1A

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
US-4161473-A 2,4,6-Trialkyl-3-hydroxyphenylalkane phosphonate and phosphinate stabilizers CIBA-GEIGY CORPORATION (US) 1979-07-17 US disclosed
US-3962376-A STABILIZERS, OXIDATION RESISTANCE, HEAT RESISTANCE, RADIATION RESISTANCE CIBA-GEIGY CORPORATION (US) 1976-06-08 US disclosed
US-3951912-A Hydroxybenzylphosphonate antioxidants AMERICAN CYANAMID COMPANY (US) 1976-04-20 US disclosed