SCHEMBL16826641

SCHEMBL16826641

Nc1nc(N2CC(N)C2)nnc1Cl

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 2/20 0.39
▸ SCN9A Q15858 4/20 0.36
▸ HRH3 Q9Y5N1 3/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ HRH4 Q9H3N8 3/20 0.31
▸ ADRA1D P25100 2/20 0.30
▸ ADRA1B P35368 2/20 0.30
▸ ADRA1A P35348 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
SCHEMBL18578679 0.86 HRH4 (0.41) PTPN11HRH3KMT2AHRH4ADRA1D
SCHEMBL18578676 0.86 HRH4 (0.41) PTPN11HRH3KMT2AHRH4ADRA1D
SCHEMBL16826784 0.84 SCN9A (0.35) PTPN11SCN9AKMT2A
SCHEMBL16854535 0.80 SCN9A (0.36) SCN9AKMT2A
SCHEMBL16854558 0.80 SCN9A (0.55) PTPN11SCN9AKMT2A
SCHEMBL16826916 0.76 SCN9A (0.34) SCN9AKMT2A
SCHEMBL16826946 0.75 KMT2A (0.36) PTPN11SCN9AKMT2A
SCHEMBL16826943 0.75 KMT2A (0.36) PTPN11SCN9AKMT2A
SCHEMBL16826847 0.75 CHRM4 (0.39) PTPN11SCN9A
SCHEMBL16826714 0.73 SCN9A (0.32) SCN9A

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-10844076-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine NEKTAR THERAPEUTICS (US) 2020-11-24 — — US disclosed
US-20190071454-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE NEKTAR THERAPEUTICS 2019-03-07 — — US disclosed
US-10189859-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine NEKTAR THERAPEUTICS (US) 2019-01-29 — — US disclosed
US-20170066782-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE NEKTAR THERAPEUTICS 2017-03-09 — — US disclosed
WO-2015092819-A2 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5- AMINE NEKTAR THERAPEUTICS (INDIA) PVT. LTD. (IN) 2015-06-25 — — 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 (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-10844076-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine KCNJ2, TRPC5, RYR2 PTPN11 1527/4885SCN9A 3833/4885HRH3 2824/4885
US-20190071454-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE KCNJ2, TRPC5, RYR2 PTPN11 1527/4885SCN9A 3833/4885HRH3 2824/4885
US-20170066782-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE KCNJ2, TRPC5, RYR2 PTPN11 1527/4885SCN9A 3833/4885HRH3 2824/4885
US-10189859-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine KCNJ2, TRPC5, RYR2 PTPN11 1527/4885SCN9A 3833/4885HRH3 2824/4885

“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.

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