SCHEMBL5066053

SCHEMBL5066053

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

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTTP P55157 11/20 0.33
POLQ O75417 1/20 0.32
DHODH Q02127 1/20 0.32
PTPN1 P18031 3/20 0.32
NTRK1 P04629 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL14031658 0.94 NTRK1 (0.35) MTTPPOLQPTPN1NTRK1
SCHEMBL5065873 0.93 NTRK1 (0.33) MTTPPOLQNTRK1
SCHEMBL5064926 0.92 MTTP (0.38) MTTPNTRK1ALDH1A1KMT2AHPGD
SCHEMBL5066074 0.89 MTTP (0.33) MTTPDHODHKMT2AMEN1
SCHEMBL5064935 0.89 MTTP (0.35) MTTPNTRK1
SCHEMBL5065147 0.88 RXFP1 (0.35) MTTPALDH1A1KMT2AKDM4EMEN1
SCHEMBL5064968 0.87 MTTP (0.34) MTTPKDM4EHPGD
SCHEMBL5065981 0.87 MTTP (0.31) MTTPNTRK1MAPTHTTNPSR1
SCHEMBL5065965 0.87 NTRK1 (0.40) NTRK1
SCHEMBL5065024 0.87 MTTP (0.39) MTTP

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 1/4885POLQ 3704/4885DHODH 599/4885

“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.