SCHEMBL14916486

SCHEMBL14916486

C/C=C/CCCOC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CTSK P43235 3/20 0.41
TDP1 Q9NUW8 2/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
FAAH O00519 1/20 0.37
EPHX2 P34913 2/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL17685210 1.00 CA12 (0.43) CA12CA1CA2CA9CTSK
SCHEMBL434612 0.84 CA12 (0.43) CA12CA1CA2CA9CTSK
SCHEMBL21416167 0.81 CTSK (0.45) CA12CA1CA2CA9CTSK
SCHEMBL8696113 0.80 TDP1 (0.63) CA12CA1CA2CA9CTSK
SCHEMBL20859578 0.80 TDP1 (0.63) CA12CA1CA2CA9CTSK
SCHEMBL18675948 0.80 CA12 (0.46) CA12CA1CA2CA9TDP1
SCHEMBL1710035 0.80 CA12 (0.48) CA12CA1CA2CA9CTSK
SCHEMBL27827148 0.79 CA12 (0.48) CA12CA1CA2CA9CTSK
SCHEMBL14917255 0.79 GAA (0.39) TDP1MEN1KMT2AGAAALDH1A1
SCHEMBL433949 0.79 GAA (0.39) TDP1MEN1KMT2AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595994-B1 PROCESS FOR PREPARING PYRANO - [2,3-C]PYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2016-04-20 EP disclosed
US-8759523-B2 Process for preparing pyrano—[2,3-C]pyridine derivatives GLAXO GROUP LIMITED (GB) 2014-06-24 US disclosed
US-20130116436-A1 PROCESS FOR PREPARING PYRANO - [2,3-C]PYRIDINE DERIVITAVES GLAXO GROUP LIMITED (GB) 2013-05-09 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-20130116436-A1 PROCESS FOR PREPARING PYRANO - [2,3-C]PYRIDINE DERIVITAVES DHPS, AKR1C3, Q6ZSR9 CA12 3388/4885CA1 1817/4885CA2 2130/4885

“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.