SCHEMBL7782487

SCHEMBL7782487

CC(C)OC1CCCC(N(Cc2ccccc2CF)CC(O)C(F)(F)F)C1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.38
SLC6A4 P31645 12/20 0.38
SLC6A3 Q01959 6/20 0.38
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PER2 O15055 1/20 0.34
CRY1 Q16526 1/20 0.34
CRY2 Q49AN0 1/20 0.34
CETP P11597 3/20 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
SCHEMBL1896263 0.90 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL993040 0.87 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL992716 0.87 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3LMNACETP
SCHEMBL995174 0.81 SLC6A2 (0.51) SLC6A2SLC6A4LMNACETP
SCHEMBL993525 0.80 IDH1 (0.35) CETP
SCHEMBL993039 0.79 SLC6A2 (0.44) SLC6A2SLC6A4LMNACETP
SCHEMBL992714 0.79 CETP (0.55) CETP
SCHEMBL993148 0.77 CETP (0.59) CETP
SCHEMBL1901254 0.77 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL5670533 0.75 CETP (0.43) SLC6A2SLC6A4LMNACETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010018446-A1 Substituted N-Aliphatic-N-Aromatictertiary-Heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. (US) 2001-08-30 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20010018446-A1 Substituted N-Aliphatic-N-Aromatictertiary-Heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, DBI, MTTP SLC6A2 993/4885SLC6A4 1073/4885SLC6A3 2166/4885

“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.