SCHEMBL4503973

SCHEMBL4503973

FC(F)(F)c1cc(CN(c2ncc(Br)cn2)C(Cc2ccccc2)c2ncc[nH]2)cc(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.40
TACR1 P25103 8/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GPBAR1 Q8TDU6 6/20 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
SCHEMBL4490431 0.69 CETP (0.40) CETPTACR1
SCHEMBL4500123 0.68 CETP (0.35) CETPGPBAR1
SCHEMBL4503976 0.67 CETP (0.42) CETPTACR1MEN1KMT2AGPBAR1
SCHEMBL3829886 0.66 CETP (0.45) CETPTACR1GPBAR1
SCHEMBL129360 0.65 CETP (0.47) CETPTACR1GPBAR1
SCHEMBL14908874 0.64 TSHR (0.42) MEN1KMT2A
SCHEMBL1587890 0.64 CETP (0.44) CETPTACR1GPBAR1
SCHEMBL1587844 0.63 SLC6A4 (0.43) CETPGPBAR1
SCHEMBL14309719 0.62 CETP (0.64) CETP
SCHEMBL14311416 0.62 CETP (0.64) 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 1 patent. 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

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 CETP 1/4885TACR1 3300/4885MEN1 2338/4885

“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.