SCHEMBL144832

SCHEMBL144832

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
SCHEMBL6166 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL767076 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL12070284 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL7087412 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 604 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372780-B1 None US claimed
US-20190144406-A1 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING THE SAME AVENTIS PHARMA SA (FR) 2019-05-16 US claimed
EP-2791122-B1 CRYSTALLINE FORM OF CABAZITAXEL AND PROCESS FOR PREPARING THE SAME AVENTIS PHARMA SA (FR) 2019-01-23 EP claimed
US-10160739-B2 Crystalline forms of dimethoxy docetaxel and methods for preparing the same AVENTIS PHARMA S.A. (FR) 2018-12-25 US claimed
US-20180002302-A1 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING THE SAME AVENTIS PHARMA S.A. (FR) 2018-01-04 US claimed
EP-2247582-B1 ANHYDROUS CRYSTALLINE FORM OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING SAME AVENTIS PHARMA SA (FR) 2016-09-07 EP claimed
US-20140350272-A1 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING THE SAME AVENTIS PHARMA S.A. (FR) 2014-11-27 US claimed
US-20140343133-A1 CRYSTALLINE FORM OF CABAZITAXEL AND PROCESS FOR PREPARING THE SAME AVENTIS PHARMA S.A. (FR) 2014-11-20 US claimed
US-8846959-B2 Crystalline forms of dimethoxy docetaxel and methods for preparing the same AVENTIS PHARMA SA (FR) 2014-09-30 US claimed
EP-2719694-A1 Anhydrous crystalline form of dimethoxy docetaxel and methods for preparing it Aventis Pharma S.A. (FR) 2014-04-16 EP claimed
US-5889043-A Taxoids, preparation thereof and pharmaceutical Compositions containing same RHONE-POULENC RORER S.A. (FR) 1999-03-30 US claimed
US-5847170-A Taxoids, their preparation and pharmaceutical compositions containing them RHONE-POULENC RORER, S.A. (FR) 1998-12-08 US claimed
EP-0876361-A1 4,10$g(b)-DIACETOXY-2$g(a)-BENZOYLOXY-5$g(b),20-EPOXY-1-HYDROXY-9-OXO-19-NOR-CYCLOPROPA G]TAX-11-ENE-13$g(a)-YL (2R,3S)-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE DIHYDRATE, AND METHOD FOR PREPARING SAME Aventis Pharma S.A. (FR) 1998-11-11 EP claimed
EP-0770070-B1 METHOD FOR PREPARING 4-ACETOXY-2ALPHA-BENZOYLOXY-5ALPHA,20-EPOXY-1,7BETA,10BETA-TRIHYDROXY-9-OXO-TAX-11-EN-13ALPHA-YL(2R,3S)-3-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE TRIHYDRATE RHONE POULENC RORER SA (FR) 1998-09-30 EP claimed
US-5670536-A Pharmaceutical composition based on taxoids RHONE-POULENC RORER S.A. (FR) 1997-09-23 US claimed
WO-1997021695-A1 4,10β-DIACETOXY-2α-BENZOYLOXY-5β,20-EPOXY-1-HYDROXY-9-OXO-19-NOR-CYCLOPROPA[G]TAX-11-ENE-13α-YL (2R,3S)-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE DIHYDRATE, AND METHOD FOR PREPARING SAME RHONE-POULENC RORER S.A. (FR) 1997-06-19 WO claimed
EP-0770070-A1 METHOD FOR PREPARING 4-ACETOXY-2ALPHA-BENZOYLOXY-5ALPHA,20-EPOXY-1,7BETA,10BETA-TRIHYDROXY-9-OXO-TAX-11-EN-13ALPHA-YL(2R,3S)-3-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE TRIHYDRATE Aventis Pharma S.A. (FR) 1997-05-02 EP claimed
EP-0690852-B1 METHOD FOR PURIFYING TAXOIDS RHONE POULENC RORER SA (FR) 1997-02-26 EP claimed
WO-1996001815-A1 METHOD FOR PREPARING 4-ACETOXY-2α-BENZOYLOXY-5β,20-EPOXY-1,7β,10β-TRIHYDROXY-9-OXO-TAX-11-EN-13α-YL(2R,3S)-3-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE TRIHYDRATE RHONE-POULENC RORER S.A. (FR) 1996-01-25 WO claimed
EP-0630428-B1 PROCESS FOR THE PREPARATION OF TAXANE DERIVATIVES RHONE POULENC RORER SA (FR) 1995-11-08 EP claimed

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-20140343133-A1 CRYSTALLINE FORM OF CABAZITAXEL AND PROCESS FOR PREPARING THE SAME TUBA3C, TALDO1, TBCA CTSK 1421/4885CTSS 1356/4885GABRB1 3038/4885

“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.