SCHEMBL7025665

SCHEMBL7025665

OC(CN(Cc1ncccc1C(F)(F)F)C1CCCC(C(F)(F)C(F)(F)F)C1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.36
CXCR4 P61073 2/20 0.35
SLC6A2 P23975 11/20 0.35
SLC6A4 P31645 11/20 0.35
SLC6A3 Q01959 2/20 0.35
ACKR3 P25106 4/20 0.32
SSTR4 P31391 1/20 0.32

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
SCHEMBL7025663 0.85 SLC6A2 (0.32) CETPSLC6A2SLC6A4SLC6A3
SCHEMBL1244525 0.77 CETP (0.35) CETP
SCHEMBL1900064 0.76 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
SCHEMBL993383 0.73 SLC6A2 (0.42) CETPSLC6A2SLC6A4SLC6A3
SCHEMBL994091 0.69 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3
SCHEMBL993681 0.68 CETP (0.36) CETP
SCHEMBL1901254 0.67 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL1900062 0.67 CETP (0.58) CETPSLC6A2SLC6A4
SCHEMBL993382 0.67 CETP (0.49) CETPSLC6A2SLC6A4
SCHEMBL992461 0.66 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3

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-20030191306-A1 Substituted N-Aliphatic-N-Aromatictertiary-Heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. (US) 2003-10-09 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-20030191306-A1 Substituted N-Aliphatic-N-Aromatictertiary-Heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, DBI, MTTP CETP 1/4885CXCR4 1942/4885SLC6A2 993/4885

“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.