SCHEMBL11045865

SCHEMBL11045865

CC(C)(C)OCC1COCCOCCOCCOCCO1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.67
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM3 P20309 1/20 0.44
TSHR P16473 3/20 0.38
MAPK1 P28482 1/20 0.38
GPR84 Q9NQS5 5/20 0.38
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARG P37231 1/20 0.32
HIF1A Q16665 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
SCHEMBL12085964 1.00 ALDH1A1 (0.67) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL11044991 1.00 ALDH1A1 (0.67) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL586673 0.98 ALDH1A1 (0.69) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL13668184 0.93 ALDH1A1 (0.58) ALDH1A1CHRM2CHRM4CHRM5CHRM3
Oxirane SCHEMBL11628011 0.88 ALDH1A1 (0.86) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL15503170 0.87 ALDH1A1 (0.55) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL15503288 0.87 ALDH1A1 (0.55) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL12086383 0.84 ALDH1A1 (0.46) ALDH1A1CHRM2CHRM4CHRM5CHRM3
SCHEMBL401560 0.81
SCHEMBL402955 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9786941-B2 Metal ionophores in PEM membranes GM Global Technology Operations LLC (US) 2017-10-10 US disclosed
US-20150105239-A1 CROWN ETHER CONTAINING PEM ELECTRODE GM GLOBAL TECH OPERATIONS INC (US) 2015-04-16 US disclosed
US-8980326-B2 Hybrid block copolymer micelles with mixed stereochemistry for encapsulation of hydrophobic agents INTEZYNE TECHNOLOGIES, INC. (US) 2015-03-17 US disclosed
US-8795924-B2 Crown ether containing PEM electrode GM Global Technology Operations LLC (US) 2014-08-05 US disclosed
US-8779008-B2 Polymeric micelles for drug delivery INTEZYNE TECHNOLOGIES, INC. (US) 2014-07-15 US disclosed
US-20140170225-A1 IMMUNOTHERAPY FOR TREATMENT OF AMYLOID-RELATED DISORDERS USING ENCAPSULATED BETA-AMYLOID PEPTIDES INTEZYNE TECHNOLOGIES INC (US) 2014-06-19 US disclosed
US-20140072901-A1 Crown Ether Containing PEM Electrode GM Global Technology Operations LLC (US) 2014-03-13 US disclosed
US-20140072900-A1 Metal Ionophores in PEM Membranes GM Global Technology Operations LLC (US) 2014-03-13 US disclosed
US-20130195987-A1 POLYMERIC MICELLES FOR DRUG DELIVERY INTEZYNE TECHNOLOGIES, INC. (US) 2013-08-01 US disclosed
US-8426477-B1 Polymeric micelles for drug delivery INTEZYNE TECHNOLOGIES, LLC (US) 2013-04-23 US disclosed
US-7638558-B2 drug loaded micelle of a triblock polymer tert-butylphenylsilylpropene-polyethylene glycol-b-poly(tert-butylaspartic acid-b-polyphenylalanine-copoly( tert-buyltyrosine) has a drug-loaded inner core, a crosslinked outer core, and a hydrophilic shell INTEZYNE TECHNOLOGIES, INC. (US) 2009-12-29 US disclosed
US-7618944-B2 Encapsulating in micelle which is a block copolymer containing hydrophilic and hydrophobic blocks INTEZYNE TECHNOLOGIES, INC. (US) 2009-11-17 US disclosed
US-7618944-B2 Encapsulating in micelle which is a block copolymer containing hydrophilic and hydrophobic blocks INTEZYNE TECHNOLOGIES, INC. (US) 2009-11-17 US disclosed
US-7612153-B2 conjugate polymer drugs; endcapped polyethers; nontoxic, biocompatible, non-immunogenic, soluble in water and other solvents INTEZYNE TECHNOLOGIES, INC. (US) 2009-11-03 US disclosed
US-20090092554-A1 ENCAPSULATED CONTRAST AGENTS INTEZYNE TECHNOLOGIES, INC. (US) 2009-04-09 US disclosed
US-20080274173-A1 Copolymer of crosslinkable or crosslinked poly(amino acid block), and a hydrophobic D,L-mixed poly(amino acid) block; an inner core, crosslinked outer core, a hydrophilic shell; improved in vivo circulation time; drug delivery INTEZYNE TECHNOLOGIES, INC. (US) 2008-11-06 US disclosed
US-20080274965-A1 ENCAPSULATED AMYLOID-BETA PEPTIDES INTEZYNE TECHNOLOGIES, INC. (US) 2008-11-06 US disclosed
US-20080274965-A1 ENCAPSULATED AMYLOID-BETA PEPTIDES INTEZYNE TECHNOLOGIES, INC. (US) 2008-11-06 US disclosed
US-4474963-A PHASE TRANSFER CATALYSTS W. R. GRACE & CO. (US) 1984-10-02 US disclosed
US-4256859-A BONDING TO CROSSLINKED CHLOROMETHYLATED POLYSTYRENE BEADS OR ACRYLATE HOMO- OR COPOLYMERS; PHASE TRANSFER AGENTS; NONTOXIC THE DOW CHEMICAL COMPANY (US) 1981-03-17 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 (5 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-20080274965-A1 ENCAPSULATED AMYLOID-BETA PEPTIDES IAPP, APP, TTR ALDH1A1 4688/4885CHRM2 2864/4885CHRM4 2903/4885
US-20130195987-A1 POLYMERIC MICELLES FOR DRUG DELIVERY ABCB4, CLTB, CD47 ALDH1A1 4414/4885CHRM2 2817/4885CHRM4 1420/4885
US-20140170225-A1 IMMUNOTHERAPY FOR TREATMENT OF AMYLOID-RELATED DISORDERS USING ENCAPSULATED BETA-AMYLOID PEPTIDES IAPP, APP, TTR ALDH1A1 4414/4885CHRM2 3313/4885CHRM4 3319/4885
US-20090092554-A1 ENCAPSULATED CONTRAST AGENTS LIPA, LPXN, CD47 ALDH1A1 3588/4885CHRM2 2504/4885CHRM4 2223/4885
US-20080274173-A1 Copolymer of crosslinkable or crosslinked poly(amino acid block), and a hydrophobic D,L-mixed poly(amino acid) block; an inner core, crosslinked outer core, a hydrophilic shell; improved in vivo circulation time; drug delivery CLTB, SLC1A5, CLTA ALDH1A1 3966/4885CHRM2 3532/4885CHRM4 3337/4885

“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.