SCHEMBL19904014

SCHEMBL19904014

CCOC(=O)/C=C/c1ccc(NC)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.69
CA1 P00915 2/20 0.69
CA2 P00918 2/20 0.69
CA7 P43166 2/20 0.69
CA9 Q16790 2/20 0.69
CA14 Q9ULX7 2/20 0.69
CYP3A4 P08684 1/20 0.60
TTR P02766 1/20 0.59
DPP4 P27487 1/20 0.59
MAOB P27338 1/20 0.54
POLB P06746 2/20 0.51
FDPS P14324 1/20 0.51
MAPT P10636 2/20 0.49
TYR P14679 1/20 0.47
APP P05067 3/20 0.47
ESR1 P03372 1/20 0.47
RAB9A P51151 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
P2RY12 Q9H244 1/20 0.46
NPC1 O15118 2/20 0.46

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
SCHEMBL7769914 1.00 CA12 (0.69) CA12CA1CA2CA7CA9
SCHEMBL5059085 0.88 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL10939791 0.88 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL13957401 0.88 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL1260527 0.86 CA12 (0.83) CA12CA1CA2CA7CA9
SCHEMBL3143890 0.86 CA12 (0.83) CA12CA1CA2CA7CA9
SCHEMBL7772753 0.86 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL7750251 0.85 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL7750247 0.85 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL5052547 0.85 CA12 (0.75) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11524004-B2 Analogs of proxisome proliferator activated receptor (PPAR) agonists and methods of using the same THE UNIVERSITY OF TOLEDO (US) 2022-12-13 US disclosed
US-20210038571-A1 Analogs of Proxisome Proliferator Activated Receptor (PPAR) Agonists and Methods of Using the Same THE UNIVERSITY OF TOLEDO (US) 2021-02-11 US disclosed
US-10776461-B2 Analogs of proxisome proliferator activated receptor (PPAR) agonists and methods of using the same THE UNIVERSITY OF TOLEDO (US) 2020-09-15 US disclosed
US-20190147147-A1 Analogs of Proxisome Proliferator Activated Receptor (PPAR) Agonists and Methods of Using the Same THE UNIVERSITY OF TOLEDO (US) 2019-05-16 US disclosed
EP-2958907-B1 BENZOTHIOPHENE DERIVATIVES AND COMPOSITIONS THEREOF AS SELECTIVE ESTROGEN RECEPTOR DEGRADERS NOVARTIS AG (CH) 2018-02-28 EP 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 (4 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-20190147147-A1 Analogs of Proxisome Proliferator Activated Receptor (PPAR) Agonists and Methods of Using the Same PPARG, PPARA, PPARD CA12 4357/4885CA1 3203/4885CA2 4015/4885
US-11524004-B2 Analogs of proxisome proliferator activated receptor (PPAR) agonists and methods of using the same PPARG, PPARA, PPARD CA12 4357/4885CA1 3203/4885CA2 4015/4885
US-10776461-B2 Analogs of proxisome proliferator activated receptor (PPAR) agonists and methods of using the same PPARG, PPARA, PPARD CA12 4357/4885CA1 3203/4885CA2 4015/4885
US-20210038571-A1 Analogs of Proxisome Proliferator Activated Receptor (PPAR) Agonists and Methods of Using the Same PPARG, PPARA, PPARD CA12 4357/4885CA1 3203/4885CA2 4015/4885

“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.