SCHEMBL7087412

SCHEMBL7087412

CC(C)(C)OC(=O)N[C@@H](c1ccccc1)[C@H](O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.51
CTSS P25774 2/20 0.51
GABRB1 P18505 1/20 0.45
GABRB2 P47870 1/20 0.45
MAPT P10636 1/20 0.45
PPARA Q07869 5/20 0.45
PPARG P37231 4/20 0.45
ATM Q13315 1/20 0.45
ACE P12821 1/20 0.44
PPARD Q03181 2/20 0.43

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
SCHEMBL335777 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL8886861 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL13363641 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL144832 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL6166 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL767076 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL12070284 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL7774670 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL8011422 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL766860 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030013889-A1 Process for the preparation of taxane derivatives AVENTIS PHARMA S.A. 2003-01-16 US disclosed
US-6433180-B1 CHEMICAL INTERMEDIATE FOR TAXOL AVENTIS PHARMA S.A. (FR) 2002-08-13 US disclosed
US-5686623-A Method for preparing taxane derivatives RHONE-POULENC RORER, S.A. (FR) 1997-11-11 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-20030013889-A1 Process for the preparation of taxane derivatives AR, CBR1, CBR3 CTSK 3749/4885CTSS 3893/4885GABRB1 4502/4885

“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.