SCHEMBL1003789

SCHEMBL1003789

CCC(Br)C(=O)OC(C)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.34
FAAH O00519 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 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
TRPA1 O75762 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
SCHEMBL9681621 0.84 TSHR (0.40) ZDHHC7FAAHTSHRALDH1A1KMT2A
SCHEMBL9683369 0.82 FAAH (0.41) ZDHHC7FAAHTSHRALDH1A1KMT2A
SCHEMBL28962586 0.80 ZDHHC7 (0.33) ZDHHC7FAAHALDH1A1KMT2A
SCHEMBL1778572 0.75
SCHEMBL2199874 0.75 ZDHHC7 (0.39) ZDHHC7TSHRALDH1A1KMT2AMGAM
SCHEMBL10552946 0.75 ZDHHC7 (0.39) ZDHHC7TSHRALDH1A1KMT2AMGAM
SCHEMBL532563 0.73
SCHEMBL1732696 0.73
SCHEMBL189345 0.73
SCHEMBL1844645 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112940518-A Wood-plastic composite material and preparation method thereof 佳诺威集团股份有限公司 2021-06-11 CN disclosed
US-9874566-B2 Compositions and methods for making and using oxygen sensing nanofibers and scaffolds UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2018-01-23 US disclosed
US-20160041177-A1 COMPOSITIONS AND METHODS FOR MAKING AND USING OXYGEN SENSING NANOFIBERS AND SCAFFOLDS Univ Virginia Patent Found (US) 2016-02-11 US disclosed
US-7955861-B2 Luminescent diketonate polymers UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2011-06-07 US disclosed
WO-2011011646-A1 LUMINESCENT DIKETONATE POLYMERS UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2011-01-27 WO disclosed
US-20090137057-A1 LUMINESCENT DIKETONATE POLYMERS UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2009-05-28 US disclosed
WO-2007143209-A2 LUMINESCENT DIKETONATE POLYMERS UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2007-12-13 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 (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-20160041177-A1 COMPOSITIONS AND METHODS FOR MAKING AND USING OXYGEN SENSING NANOFIBERS AND SCAFFOLDS ILK, HIF1A, TNNI3 ZDHHC7 3427/4885FAAH 4722/4885TSHR 4831/4885

“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.