SCHEMBL1963204

SCHEMBL1963204

CCOc1ccccc1-c1nc2ccccc2n(CC(=O)NC)c1=O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
GRIN1 Q05586 1/20 0.54
GRIN2B Q13224 1/20 0.54
POLB P06746 5/20 0.52
TDP1 Q9NUW8 1/20 0.52
MEN1 O00255 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 1/20 0.48
MMP9 P14780 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
MMP2 P08253 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL8325537 0.76 GSK3B (0.52) MAPTPOLBTDP1MEN1KMT2A
SCHEMBL12497263 0.71 LMNA (0.69) POLBMEN1KMT2A
SCHEMBL20134527 0.70 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL12501224 0.68 HDAC1 (0.56) MMP2TP53
Trifluoroacetic Acid SCHEMBL7817211 0.68 MAPT (0.43) MAPTMMP2
SCHEMBL28995203 0.67 LMNA (0.56) POLBTDP1MEN1KMT2AMMP2
SCHEMBL31448466 0.67 MAPT (0.67) MAPTMEN1MAPK1KMT2A
SCHEMBL5521696 0.66 KDM4E (0.75) MAPT
SCHEMBL928940 0.66 MTOR (0.46) MAPTMEN1KMT2ATP53
SCHEMBL980645 0.66 MAPK1 (0.57) MAPTPOLBTDP1MEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE BAYER CROPSCIENCE AG (DE) 2011-06-16 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-20110143939-A1 QUINOXALIN-2-ONE DERIVATIVES, COMPOSITIONS WHICH PROTECT USEFUL PLANTS AND COMPRISE THESE DERIVATIVES, AND PROCESSES FOR THEIR PREPARATION AND THEIR USE QSOX1, PRDX2, NQO2 MAPT 4235/4885GRIN1 820/4885GRIN2B 1780/4885

“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.