SCHEMBL3573901

SCHEMBL3573901

Cn1nnc(N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)Cc2cc(C(F)(F)F)cnc2COCC2CCCCC2)n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CETP P11597 15/20 0.36
TACR1 P25103 2/20 0.36
APAF1 O14727 2/20 0.35
UBE2N P61088 2/20 0.35
IDE P14735 1/20 0.35
RECQL P46063 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SGMS1 Q86VZ5 1/20 0.33
SGMS2 Q8NHU3 1/20 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
SCHEMBL1599490 0.87 CETP (0.42) CETPTACR1
SCHEMBL1600356 0.86 CETP (0.42) CETPTACR1
SCHEMBL1599506 0.83 CETP (0.39) CETPTACR1
SCHEMBL1600347 0.83 CETP (0.43) CETPTACR1
SCHEMBL4220331 0.82 CETP (0.37) CETPAPAF1UBE2NIDERECQL
SCHEMBL4223082 0.81 CETP (0.38) CETPAPAF1UBE2NIDERECQL
SCHEMBL1599615 0.81 CETP (0.41) CETPTACR1
SCHEMBL1599609 0.81 CETP (0.42) CETPTACR1SGMS1SGMS2
SCHEMBL4217794 0.81 CETP (0.37) CETPAPAF1UBE2NIDERECQL
SCHEMBL1599481 0.80 CETP (0.36) CETPTACR1

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-20100076021-A1 Organic Compounds IMASE HIDETOMO 2010-03-25 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 (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-20100076021-A1 Organic Compounds CETP, NPC1, LCAT CETP 1/4885TACR1 1439/4885APAF1 882/4885

“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.