SCHEMBL5336861

SCHEMBL5336861

CCC1(C)CC(NC(=O)CCCO)C(C)C(C)(CC)N1OC(C)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ASAH1 Q13510 1/20 0.30
ACER2 Q5QJU3 1/20 0.30
CYP3A4 P08684 2/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
TSHR P16473 1/20 0.30
BCHE P06276 2/20 0.30
ACHE P22303 2/20 0.30

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
SCHEMBL6322074 0.96 ASAH1 (0.33) MAPTHTTALDH1A1ASAH1ACER2
SCHEMBL14590810 0.94 NPSR1 (0.36) MAPTHTTL3MBTL1ALDH1A1ASAH1
SCHEMBL6322560 0.93 ASAH1 (0.39) MAPTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL5345145 0.93 HTT (0.34) HTTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL5341797 0.93 HTT (0.34) HTTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL7123674 0.92 ASAH1 (0.40) MAPTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL6324729 0.92 ASAH1 (0.40) MAPTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL6328123 0.92 ASAH1 (0.40) MAPTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL6329147 0.92 ASAH1 (0.40) MAPTALDH1A1ASAH1ACER2CYP3A4
SCHEMBL6320903 0.92 ASAH1 (0.40) MAPTALDH1A1ASAH1ACER2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6624306-B2 Stabilizer for addition polymer CIBA SPECIALTY CHEMICALS CORPORATION 2003-09-23 US claimed
US-20030166939-A1 2,2,6,6 diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides NESVADBA PETER (CH) 2003-09-04 US claimed
US-20030065184-A1 2,2,6,6 diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides CIBA SPECIALTY CHEMICALS CORP. 2003-04-03 US claimed
US-7160966-B2 2,2,6,6 Diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides CIBA SPECIALTY CHEMICALS CORP. (US) 2007-01-09 US disclosed
US-7160966-B2 2,2,6,6 Diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides CIBA SPECIALTY CHEMICALS CORP. (US) 2007-01-09 US disclosed
US-7160966-B2 2,2,6,6 Diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides CIBA SPECIALTY CHEMICALS CORP. (US) 2007-01-09 US disclosed
US-20050143539-A1 2,2,6,6 Diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides NESVADBA PETER (CH) 2005-06-30 US disclosed
US-6624306-B2 Stabilizer for addition polymer CIBA SPECIALTY CHEMICALS CORPORATION 2003-09-23 US disclosed
US-20030065184-A1 2,2,6,6 diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides CIBA SPECIALTY CHEMICALS CORP. 2003-04-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030166939-A1 2,2,6,6 diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides ALKBH2, NFE2L2, DPYSL2 MAPT 3356/4885HTT 3742/4885L3MBTL1 2282/4885
US-20050143539-A1 2,2,6,6 Diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides ALKBH2, NFE2L2, DPYSL2 MAPT 3356/4885HTT 3742/4885L3MBTL1 2282/4885
US-20030065184-A1 2,2,6,6 diethyl-dimethyl-1-alkoxy-piperidine compounds and their corresponding 1-oxides ALKBH2, NFE2L2, DPYSL2 MAPT 3356/4885HTT 3742/4885L3MBTL1 2282/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.