SCHEMBL5064941

SCHEMBL5064941

CCOC(=O)C(COC(=O)Oc1c(F)cc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c(OC(C)C)c1F)(C(=O)OCC)c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTTP P55157 16/20 0.38
APOB P04114 4/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
NTRK1 P04629 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL5061943 0.93 MTTP (0.38) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5065855 0.92 ALDH1A1 (0.39) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5066031 0.90 MTTP (0.37) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5064942 0.90 MTTP (0.36) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5065169 0.89 MTTP (0.41) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5064926 0.87 MTTP (0.38) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5068058 0.86 MTTP (0.38) MTTPAPOB
SCHEMBL5061948 0.85 MTTP (0.36) MTTPALDH1A1HPGDKMT2ANTRK1
SCHEMBL5065877 0.84 MTTP (0.39) MTTPAPOBALDH1A1HPGDKMT2A
SCHEMBL5062326 0.84 MTTP (0.38) MTTPAPOBALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1669345-A1 ESTER DERIVATIVE AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2006-06-14 EP claimed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-20060205726-A1 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2006-09-14 US disclosed
EP-1669345-A1 ESTER DERIVATIVE AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2006-06-14 EP 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-20060205726-A1 Ester derivatives and medical use thereof MTTP, LIPC, CETP MTTP 1/4885APOB 39/4885ALDH1A1 733/4885

“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.