SCHEMBL1736059

SCHEMBL1736059

CCOC(=O)C(O)(CCC=C(C)C)CC(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.37
PKM P14618 3/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL14624782 0.87 TSHR (0.36) ALOX15PKMTHRBHTTKDM4E
SCHEMBL14634538 0.85 PKM (0.36) PKMTHRBHTTKDM4EMEN1
SCHEMBL3763202 0.84 ALOX15 (0.38) ALOX15LMNA
SCHEMBL1734711 0.81 ALOX15 (0.37) ALOX15KDM4EMEN1KMT2AATM
SCHEMBL12746064 0.77 ALOX15 (0.40) ALOX15
SCHEMBL13059661 0.76 CYP4F2 (0.38) PKMTHRBHTTKDM4EMEN1
SCHEMBL6434714 0.74 ALOX15 (0.43) ALOX15KDM4EMEN1KMT2AATM
Triethyl Citrate SCHEMBL21518137 0.74 GAA (0.43) PKMTHRBHTTKDM4EMEN1
SCHEMBL4942630 0.74 PKM (0.40) PKMTHRBHTTKDM4EMEN1
SCHEMBL14634208 0.73 GAA (0.38) PKMTHRBHTTKDM4EMEN1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018019549-A1 DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE INDENA S.P.A. (IT) 2018-02-01 WO disclosed
EP-3275875-A1 DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE INDENA S.p.A. (IT) 2018-01-31 EP disclosed
US-RE45128-E1 Cephalotaxane derivatives and their processes of preparation and purification IVAX International GmbH (CH) 2014-09-09 US disclosed
US-RE45128-E1 Cephalotaxane derivatives and their processes of preparation and purification IVAX International GmbH (CH) 2014-09-09 US disclosed
EP-1907371-B1 PROCESS FOR PREPARING 2-METHOXYCARBONYLMETHYL-6,6-DIMETHYL-2- TETRAHYDROPYRAN CARBOXYLIC ACID ERREGIERRE SPA (IT) 2011-11-23 EP disclosed
US-8008514-B2 Process for preparing 2-methoxycarbonylmethyl-6,6-dimethyl-2-tetrahydropyran carboxylic acid ERREGIERRE S.P.A. (IT) 2011-08-30 US disclosed
US-8008514-B2 Process for preparing 2-methoxycarbonylmethyl-6,6-dimethyl-2-tetrahydropyran carboxylic acid ERREGIERRE S.P.A. (IT) 2011-08-30 US disclosed
CN-101233123-B Process for the preparation of 2-methoxycarbonylmethyl-6, 6-dimethyl-2-tetrahydropyran carboxylic acid ERREGIERRE SPA 2011-05-11 CN disclosed
US-7842687-B2 Natural, synthetic or semi-synthetic crude harringtonines purified by chromatography and crystallization in which the solvent is water or lower C1-4 alkanol or an aqueous mixture of organic solvents; treatment of cancer through oral administration CHEMGENEX PHARMACEUTICALS, INC. (AU) 2010-11-30 US disclosed
US-7842687-B2 Natural, synthetic or semi-synthetic crude harringtonines purified by chromatography and crystallization in which the solvent is water or lower C1-4 alkanol or an aqueous mixture of organic solvents; treatment of cancer through oral administration CHEMGENEX PHARMACEUTICALS, INC. (AU) 2010-11-30 US disclosed
US-7169774-B2 Cephalotaxane derivatives and their processes of preparation and purification STRAGEN PHARMA S.A. (CH) 2007-01-30 US disclosed
US-7169774-B2 Cephalotaxane derivatives and their processes of preparation and purification STRAGEN PHARMA S.A. (CH) 2007-01-30 US disclosed
US-20060234999-A1 Cephalotaxane derivatives and their processes of preparation and purification TEVA PHARMACEUTICALS INTERNATIONAL GMBH (CH) 2006-10-19 US disclosed
US-20050090484-A1 Cephalotaxane derivatives and their processes of preparation and purification IVAX International GmbH (CH) 2005-04-28 US disclosed
EP-1064285-B1 NOVEL CEPHALOTAXANE DERIVATIVES AND PROCESS FOR THEIR PREPARATION STRAGEN PHARMA SA (CH) 2005-02-16 EP disclosed
US-6831180-B1 Substituted tertiary carboxylic oxacycloalkane acids, used to prepare anhydro-homo-harringtonic acids by semi-synthesis; hydroxyl function of a cephalotaxane is esterified with a 2-carboxyl-2-alkyl-1-oxacycloalkane claimed intermediate; (indexing from 7169774 added) STRAGEN PHARMA SA. (CH) 2004-12-14 US disclosed
US-6613900-B2 Asymetric hemisynthesis of harringtonines and their analogs, that are alkaloids used in chemotherapy. ONCOPHARM CORPORATION 2003-09-02 US disclosed
US-20020045750-A1 Asymetric hemisynthesis of harringtonines and their analogs, that are alkaloids used in chemotherapy. IVAX International GmbH (CH) 2002-04-18 US disclosed
EP-1064285-A1 NOVEL CEPHALOTAXANE DERIVATIVES AND PROCESS FOR THEIR PREPARATION Oncopharm Corporation (US) 2001-01-03 EP disclosed
WO-1999048894-A1 NOVEL CEPHALOTAXANE DERIVATIVES AND PROCESS FOR THEIR PREPARATION ONCOPHARM CORPORATION (US) 1999-09-30 WO 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 (3 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-20060234999-A1 Cephalotaxane derivatives and their processes of preparation and purification UGT1A7, CYP8B1, UGT2B7 ALOX15 1186/4885PKM 3591/4885THRB 1874/4885
US-20020045750-A1 Asymetric hemisynthesis of harringtonines and their analogs, that are alkaloids used in chemotherapy. AAAS, AARS1, AADAT ALOX15 722/4885PKM 3448/4885THRB 2615/4885
US-20050090484-A1 Cephalotaxane derivatives and their processes of preparation and purification UGT1A7, CYP8B1, UGT2B7 ALOX15 1186/4885PKM 3591/4885THRB 1874/4885

“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.