SCHEMBL4510002

SCHEMBL4510002

Cc1cccc2cc(CN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ncc(OCCS(C)(=O)=O)cn3)c(OCc3ccccc3)nc12

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.37
CETP P11597 7/20 0.35
CASR P41180 1/20 0.33
TACR1 P25103 3/20 0.33
ATP4A P20648 1/20 0.32
ATP4B P51164 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
PIK3CD O00329 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
SCHEMBL4499332 0.91 NR3C1 (0.34) NR3C1CETPCASRTACR1PIK3CD
SCHEMBL4497887 0.87 CETP (0.38) NR3C1CETPTACR1PIK3CD
SCHEMBL4501452 0.87 NR3C1 (0.35) NR3C1CETPCASRTACR1PIK3CD
SCHEMBL4494930 0.86 CETP (0.41) NR3C1CETPTACR1
SCHEMBL130526 0.81 CETP (0.39) CETP
SCHEMBL4511758 0.81 CETP (0.34) CETPTACR1PIK3CD
SCHEMBL4501835 0.78 CETP (0.50) CETP
SCHEMBL129204 0.74 CETP (0.39) CETP
SCHEMBL129892 0.73 CETP (0.36) CETP
SCHEMBL132562 0.73 CETP (0.40) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023729-A1 Trisubstituted amine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-01-22 US disclosed
EP-1979341-A1 TRISUBSTITUTED AMINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-10-15 EP disclosed
WO-2007088999-A1 TRISUBSTITUTED AMINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-08-09 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-20090023729-A1 Trisubstituted amine compound CETP, MTTP, APOB NR3C1 3090/4885CETP 1/4885CASR 4758/4885

“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.