SCHEMBL5065207

SCHEMBL5065207

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

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.35
NTRK2 Q16620 1/20 0.35
LMNA P02545 2/20 0.34
CASR P41180 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
F10 P00742 1/20 0.33
RORC P51449 1/20 0.33
DHODH Q02127 1/20 0.33
GAA P10253 1/20 0.33
MTTP P55157 3/20 0.33
IGF2BP2 Q9Y6M1 1/20 0.33
OPRL1 P41146 1/20 0.32
RXFP1 Q9HBX9 2/20 0.32
ELANE P08246 1/20 0.32
PRTN3 P24158 1/20 0.32
LIPE Q05469 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
SCHEMBL5065162 0.94 NTRK1 (0.42) NTRK1NTRK2LMNACASRKDM4E
SCHEMBL5061956 0.90 F10 (0.36) NTRK1KDM4EF10MTTPRXFP1
SCHEMBL5065208 0.89 CASR (0.31) NTRK1NTRK2CASRF10RORC
SCHEMBL5066043 0.89 CASR (0.43) NTRK1NTRK2LMNACASRKDM4E
SCHEMBL5065185 0.88 LCK (0.39) NTRK1LMNACASRF10OPRL1
SCHEMBL5065148 0.87 MTTP (0.44) MTTP
SCHEMBL5062406 0.87 MTTP (0.38) NTRK1MTTPIGF2BP2RXFP1
SCHEMBL14031657 0.87 NTRK1 (0.40) NTRK1NTRK2LMNACASRF10
SCHEMBL5065928 0.82 NTRK1 (0.41) NTRK1NTRK2LMNACASRF10
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 5 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
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 NTRK1 4115/4885NTRK2 3028/4885LMNA 2938/4885

“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.