SCHEMBL16910643

SCHEMBL16910643

Cn1ncc(C(=O)c2nn(C)c(=O)n(-c3ccccc3)c2=O)c1O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.39
ALDH1A1 P00352 9/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
HTT P42858 1/20 0.36
PTGS2 P35354 1/20 0.36
ALDH1A3 P47895 8/20 0.36
ALDH1A2 O94788 7/20 0.36
MAPK1 P28482 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
SCHEMBL248654 0.78 GSK3A (0.47) PGRALDH1A1LMNAMAPTKMT2A
SCHEMBL14877423 0.76 GSK3A (0.44) PGRALDH1A1KMT2AMEN1USP2
SCHEMBL10751885 0.73 MAPK14 (0.50) ALDH1A1LMNAMAPTHSD17B10KMT2A
SCHEMBL20720005 0.72 SMN1; SMN2 (0.41) PGRALDH1A1LMNAMAPTHSD17B10
SCHEMBL16021998 0.70 ALDH1A1 (0.54) ALDH1A1MAPTHSD17B10KMT2AMEN1
SCHEMBL17222514 0.68 POLB (0.51) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL17427482 0.68 TYRO3 (0.38) PGRALDH1A1MAPTKMT2AMEN1
SCHEMBL10755351 0.67 POLB (0.46) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL18816329 0.67 KDR (0.30)
SCHEMBL28879227 0.67 GSK3A (0.52) PGRALDH1A1GSK3AGSK3BALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9573909-B2 6-acyl-1,2,4-triazine-3,5-dione derivative and herbicides FMC CORPORATION (US) 2017-02-21 US disclosed
US-20150203457-A1 6-ACYL-1,2,4-TRIAZINE-3,5-DIONE DERIVATIVE AND HERBICIDES IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2015-07-23 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-20150203457-A1 6-ACYL-1,2,4-TRIAZINE-3,5-DIONE DERIVATIVE AND HERBICIDES DDT, AADAC, DAZAP1 PGR 4679/4885ALDH1A1 144/4885LMNA 4620/4885

“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.