SCHEMBL719675

SCHEMBL719675

C=Cc1c(OC)nc(C2CC2)nc1C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.37
PDE4D Q08499 2/20 0.33
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
SLC6A3 Q01959 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL721626 0.83 NPSR1 (0.37) NPSR1PDE4DTSHRMAPK1SLC6A3
SCHEMBL719004 0.81 TSHR (0.36) NPSR1TSHRMAPK1
SCHEMBL720293 0.81 MEN1 (0.35) NPSR1
SCHEMBL11902735 0.81 NPSR1 (0.35) NPSR1
SCHEMBL717342 0.81 NPSR1 (0.35) NPSR1
SCHEMBL719496 0.80 NPSR1 (0.34) NPSR1
SCHEMBL11902736 0.80 NPSR1 (0.34) NPSR1TSHRMAPK1MTNR1AMTNR1B
SCHEMBL720885 0.78 NPSR1 (0.40) NPSR1PDE4DTSHRMAPK1SLC6A3
SCHEMBL27863723 0.77 NPSR1 (0.32) NPSR1
SCHEMBL10285697 0.75

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
US-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-01 US disclosed
US-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-01 US disclosed
WO-2010092339-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2010-08-19 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-20120053053-A1 PYRIMIDINE DERIVATIVES AND THEIR USE AS HERBICIDES DPYD, DHODH, TYMP NPSR1 3040/4885PDE4D 1603/4885TSHR 1099/4885

“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.