SCHEMBL6428076

SCHEMBL6428076

CCC(C1CCCN1)N(c1ccc(OC)c(Cl)c1)c1nc(N)nc(NCn2ccnc2)n1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GCK P35557 1/20 0.31
TLR7 Q9NYK1 1/20 0.30
MAPK1 P28482 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
SCHEMBL6427798 0.82 MEN1 (0.34) POLBMEN1KMT2ASMN1; SMN2GCK
SCHEMBL6428054 0.78 MAPK1 (0.32) MAPK1
SCHEMBL6428071 0.77 DRD2 (0.35) POLBSMN1; SMN2
SCHEMBL6428528 0.77 GALR1 (0.35) MAPK1
SCHEMBL5554034 0.77 GALR1 (0.38) MEN1KMT2ASMN1; SMN2TLR7MAPK1
SCHEMBL5036469 0.76 BCDIN3D (0.34)
SCHEMBL5555729 0.76 MAPK1 (0.35) MAPK1
SCHEMBL6607370 0.76 GALR1 (0.39) MEN1KMT2ASMN1; SMN2TLR7MAPK1
SCHEMBL5412214 0.76 TACR1 (0.35) MAPK1
SCHEMBL4831998 0.76 MAPT (0.39) POLBMEN1KMT2AMAPK1

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-20050124619-A1 Medical devices employing triazine compounds and compositions thereof DR. REDDY'S LABORATORIES LTD. (IN) 2005-06-09 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-20050124619-A1 Medical devices employing triazine compounds and compositions thereof PTGIS, AREG, TGFB1 POLB 3982/4885MEN1 4510/4885KMT2A 3506/4885

“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.