SCHEMBL13608939

SCHEMBL13608939

CC[C@@H]1C[C@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@H](Cc2ccc(F)cc2)N1C(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CETP P11597 9/20 0.60
TACR1 P25103 7/20 0.42
CCR2 P41597 4/20 0.38
KCNH2 Q12809 2/20 0.38

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
SCHEMBL14309731 1.00 CETP (0.60) CETPTACR1CCR2KCNH2
SCHEMBL3943995 1.00 CETP (0.60) CETPTACR1CCR2KCNH2
SCHEMBL13608938 1.00 CETP (0.60) CETPTACR1CCR2KCNH2
SCHEMBL4070454 0.92 CETP (0.59) CETPTACR1CCR2
SCHEMBL13608951 0.92 CETP (0.59) CETPTACR1CCR2
SCHEMBL13608454 0.92 CETP (0.70) CETPTACR1CCR2
SCHEMBL4073494 0.91 CETP (0.58) CETPTACR1CCR2
SCHEMBL13608954 0.91 CETP (0.58) CETPTACR1CCR2
SCHEMBL13608923 0.91 CETP (0.66) CETPTACR1CCR2
SCHEMBL13608921 0.91 CETP (0.66) CETPTACR1CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286790-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-11-19 US disclosed
US-20090286790-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-11-19 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-20090286790-A1 ORGANIC COMPOUNDS CETP, NPC1, CES1 CETP 1/4885TACR1 796/4885CCR2 2267/4885

“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.