SCHEMBL5065162

SCHEMBL5065162

CCOC(=O)C(COC(=O)Oc1ccc(NC(=O)c2ccc(C)nc2-c2ccc(C(F)(F)F)cc2)c(C(=O)N(C)C)c1)(C(=O)OCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.42
NTRK2 Q16620 1/20 0.42
KDM4E B2RXH2 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CASR P41180 1/20 0.34
OPRL1 P41146 1/20 0.34
F10 P00742 1/20 0.34
LMNA P02545 2/20 0.33
DHODH Q02127 1/20 0.33
MTTP P55157 3/20 0.33
SORT1 Q99523 2/20 0.33
IGF2BP2 Q9Y6M1 1/20 0.33
RXFP1 Q9HBX9 2/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL5065207 0.94 NTRK1 (0.35) NTRK1NTRK2KDM4EHTTSMN1; SMN2
SCHEMBL14031657 0.91 NTRK1 (0.40) NTRK1NTRK2CASROPRL1F10
SCHEMBL5061956 0.90 F10 (0.36) NTRK1KDM4EF10MTTPRXFP1
SCHEMBL5066043 0.89 CASR (0.43) NTRK1NTRK2KDM4EHTTSMN1; SMN2
SCHEMBL5065185 0.89 LCK (0.39) NTRK1CASROPRL1F10LMNA
SCHEMBL5065148 0.88 MTTP (0.44) MTTPALDH1A1HPGDKMT2A
SCHEMBL5062406 0.87 MTTP (0.38) NTRK1MTTPIGF2BP2RXFP1
SCHEMBL5065928 0.87 NTRK1 (0.41) NTRK1NTRK2CASROPRL1F10
SCHEMBL5065208 0.83 CASR (0.31) NTRK1NTRK2CASRF10MTTP
SCHEMBL5062030 0.82 MTTP (0.43) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 NTRK1 4115/4885NTRK2 3028/4885KDM4E 3279/4885

“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.