SCHEMBL11890779

SCHEMBL11890779

CC(C)(CCC(=O)O)/N=N/C(C)(C)CCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.45
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
CYP3A4 P08684 1/20 0.41
ESR2 Q92731 1/20 0.41
LMNA P02545 4/20 0.40
ALKBH5 Q6P6C2 1/20 0.40
SUCNR1 Q9BXA5 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
FFAR3 O14843 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
SLC15A2 Q16348 1/20 0.38
TSHR P16473 4/20 0.37

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
SCHEMBL12587323 1.00 NAALAD2 (0.45) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL19418849 0.83 NAALAD2 (0.37) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL11860102 0.82 NAALAD2 (0.43) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL12563618 0.81 NAALAD2 (0.33) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL18868413 0.81 NAALAD2 (0.33) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL14341006 0.80 NAALAD2 (0.33) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL19837820 0.77 TSHR (0.46) ALDH1A1MEN1KMT2AESR1LMNA
SCHEMBL19837821 0.77 TSHR (0.46) ALDH1A1MEN1KMT2AESR1LMNA
SCHEMBL13178448 0.75 ALDH1A1 (0.48) NAALAD2ALDH1A1MEN1CYP1A2THRB
SCHEMBL28323929 0.75 ALDH1A1 (0.48) NAALAD2ALDH1A1MEN1CYP1A2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3908246-B1 INCORPORATION OF CHITOSAN IN MICROCAPSULE WALL ENCAPSYS LLC (US) 2024-11-20 EP disclosed
US-11260359-B2 Incorporation of chitosan in microcapsule wall ENCAPSYS, LLC 2022-03-01 US disclosed
EP-3908246-A1 INCORPORATION OF CHITOSAN IN MICROCAPSULE WALL Encapsys, LLC (US) 2021-11-17 EP disclosed
WO-2020146691-A1 INCORPORATION OF CHITOSAN IN MICROCAPSULE WALL ENCAPSYS, LLC (US) 2020-07-16 WO disclosed
US-20200222873-A1 Incorporation of chitosan in microcapsule wall ENCAPSYS, LLC (US) 2020-07-16 US disclosed
US-20170247317-A1 COMPOUNDS, MONOMERS, AND POLYMERS CONTAINING A CARBONATE LINKAGE ISP INVESTMENTS LLC (US) 2017-08-31 US disclosed
US-9650335-B2 Compounds, monomers, and polymers containing a carbonate linkage ISP INVESTMENTS LLC (US) 2017-05-16 US disclosed
US-9056141-B2 Thiol-ene click chemistry for drug conjugates SYNCHEM, INC. (US) 2015-06-16 US disclosed
WO-2012099847-A2 COMPOUNDS, MONOMERS, AND POLYMERS CONTAINING A CARBONATE LINKAGE ISP INVESTMENTS INC. (US) 2012-07-26 WO disclosed
US-20110120646-A1 TWO-PART EPOXY-BASED STRUCTURAL ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY 2011-05-26 US disclosed
US-20110120646-A1 TWO-PART EPOXY-BASED STRUCTURAL ADHESIVES 3M INNOVATIVE PROPERTIES COMPANY 2011-05-26 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-20170247317-A1 COMPOUNDS, MONOMERS, AND POLYMERS CONTAINING A CARBONATE LINKAGE PARN, CD38, PARG NAALAD2 2393/4885ALDH1A1 3988/4885MEN1 67/4885

“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.