SCHEMBL3576572

SCHEMBL3576572

CCC(O)c1ncc(C(F)(F)F)cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnn(C)n1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CETP P11597 19/20 0.39
TACR1 P25103 1/20 0.36

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
SCHEMBL4186468 0.87 CETP (0.44) CETPTACR1
SCHEMBL3574603 0.85 CETP (0.37) CETPTACR1
SCHEMBL3573798 0.85 CETP (0.37) CETPTACR1
SCHEMBL13918433 0.83 TACR1 (0.38) CETPTACR1
SCHEMBL3224312 0.82 TACR1 (0.38) CETPTACR1
SCHEMBL3579894 0.82 CETP (0.37) CETPTACR1
SCHEMBL3578647 0.82 CETP (0.37) CETP
SCHEMBL4223079 0.82 CETP (0.38) CETP
SCHEMBL3569455 0.81 CETP (0.36) CETP
SCHEMBL3215672 0.81 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076021-A1 Organic Compounds IMASE HIDETOMO 2010-03-25 US disclosed
US-20100076021-A1 Organic Compounds IMASE HIDETOMO 2010-03-25 US disclosed
US-20100076021-A1 Organic Compounds IMASE HIDETOMO 2010-03-25 US disclosed
EP-2084149-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2009-08-05 EP disclosed
WO-2008058967-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-05-22 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-20100076021-A1 Organic Compounds CETP, NPC1, LCAT CETP 1/4885TACR1 1439/4885

“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.