SCHEMBL431969

SCHEMBL431969

CCOC(CCCOCCOCO)OCC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL431930 0.86 TSHR (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL1639686 0.82 CYP3A4 (0.32) TSHR
SCHEMBL434384 0.81 TSHR (0.34) MEN1THRBHTTKMT2AMAPT
SCHEMBL9252191 0.78 TSHR (0.41) MEN1THRBHTTKMT2AMAPT
SCHEMBL14590764 0.73
SCHEMBL1146478 0.73 ALDH1A1 (0.36) MEN1THRBKMT2ATSHRALDH1A1
SCHEMBL31079405 0.73 THRB (0.40) THRB
SCHEMBL13319641 0.72 ALDH1A1 (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL6227646 0.72 THRB (0.44) THRB
SCHEMBL7753817 0.72 THRB (0.44) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853325-B2 Water-soluble polymer alkanals NEKTAR THERAPEUTICS (US) 2014-10-07 US disclosed
US-20120065429-A1 WATER-SOLUBLE POLYMER ALKANALS NEKTAR THERAPEUTICS (US) 2012-03-15 US disclosed
US-8076412-B2 Water-soluble polymer alkanals NEKTAR THERAPEUTICS (US) 2011-12-13 US disclosed
US-20110034737-A1 Water-Soluble Polymer Alkanals NEKTAR THERAPEUTICS (US) 2011-02-10 US disclosed
US-7838595-B2 high purity; storage stability; electrophilically activated polymer derivatives with aldehyde functionality for conjugating to biologically active molecules; drug-polymer conjugate; NEKTAR THERAPEUTICS (US) 2010-11-23 US disclosed
US-20090234070-A1 high purity; storage stability; electrophilically activated polymer derivatives with aldehyde functionality for conjugating to biologically active molecules; drug-polymer conjugate; NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-09-17 US disclosed
US-7511094-B2 2-methylbutyraldehyde diethyl acetal end capped polyoxyethylene glycol; polyalkylene oxide, polyivnylpyrrolidone, polyvinyl alcohol, polyoxazoline etc. endcapped with polyetherpolyamine copolymers or oligomers covalently attached to diacetal tetramethylene group NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-03-31 US disclosed
US-7157546-B2 Polyoxyethylene glycol; purity, storage stability NEKTAR THERAPEUTICS AL, CORPORATION (US) 2007-01-02 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 (2 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-20120065429-A1 WATER-SOLUBLE POLYMER ALKANALS ALK, ALKBH3, AQP1 MEN1 4247/4885THRB 4877/4885HTT 837/4885
US-20110034737-A1 Water-Soluble Polymer Alkanals ALK, ALKBH3, AQP1 MEN1 4247/4885THRB 4877/4885HTT 837/4885

“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.