SCHEMBL4220331

SCHEMBL4220331

Cn1nnc(N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)Cc2cc(C(F)(F)F)cnc2NCC2CCCCC2)n1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 17/20 0.37
APAF1 O14727 2/20 0.36
UBE2N P61088 2/20 0.36
IDE P14735 1/20 0.36
RECQL P46063 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GLS O94925 1/20 0.34

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
SCHEMBL4223860 0.92 CETP (0.37) CETPAPAF1UBE2NIDERECQL
SCHEMBL3207206 0.85 GLS (0.43) CETPGLS
SCHEMBL3579891 0.84 CETP (0.37) CETPAPAF1UBE2NIDERECQL
SCHEMBL4223082 0.82 CETP (0.38) CETPAPAF1UBE2NIDERECQL
SCHEMBL4217794 0.82 CETP (0.37) CETPAPAF1UBE2NIDERECQL
SCHEMBL3573901 0.82 CETP (0.36) CETPAPAF1UBE2NIDERECQL
SCHEMBL4217787 0.81 CETP (0.38) CETPAPAF1UBE2NIDERECQL
SCHEMBL3205200 0.80 SGMS2 (0.40) CETP
SCHEMBL4220329 0.80 CETP (0.39) CETP
SCHEMBL3221198 0.80 CETP (0.41) CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
WO-2007073934-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) NOVARTIS AG (CH) 2007-07-05 WO 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 (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-20090075968-A1 CETP inhibitors CETP, PCSK9, MTTP CETP 1/4885APAF1 1073/4885UBE2N 4582/4885

“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.