SCHEMBL5032275

SCHEMBL5032275

CN1CCN(c2nc(N)nc(N)n2)CC1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 19/20 0.78
HRH3 Q9Y5N1 2/20 0.58
HTR6 P50406 1/20 0.58

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
SCHEMBL128037 0.88 HRH4 (0.59) HRH4
SCHEMBL10453209 0.88 HRH4 (0.59) HRH4
SCHEMBL4369596 0.88 HRH4 (1.00) HRH4HRH3HTR6
SCHEMBL17581165 0.86 HRH4 (0.66) HRH4HRH3HTR6
SCHEMBL1966112 0.85 HRH4 (0.64) HRH4HRH3
SCHEMBL19439697 0.85 HRH4 (0.64) HRH4HRH3HTR6
SCHEMBL12455903 0.83 HRH4 (1.00) HRH4HTR6
SCHEMBL11150401 0.83 HRH4 (0.59) HRH4HRH3HTR6
SCHEMBL27082996 0.83 HRH4 (0.59) HRH4HRH3HTR6
SCHEMBL8413177 0.79 HRH4 (1.00) HRH4HRH3HTR6

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
WO-2017168454-A2 NOVEL COMPOUNDS AS BTK INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2017-10-05 WO disclosed
US-7332490-B2 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2008-02-19 US disclosed
US-20060258641-A1 Methods and compositions of novel triazine compounds DR. REDDY'S LABORATORIES LTD. (IN) 2006-11-16 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-20060258641-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS HRH4 607/4885HRH3 1023/4885HTR6 1950/4885

“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.