SCHEMBL6429682

SCHEMBL6429682

CCC(C1CCCN1)N(c1ccc(OC)c(F)c1)c1nc(N)nc(NCC2CCC(N)C2)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.32
GALR1 P47211 1/20 0.31

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
SCHEMBL6428528 0.94 GALR1 (0.35) MAPK1GALR1
SCHEMBL5554034 0.92 GALR1 (0.38) MAPK1GALR1
SCHEMBL6607370 0.91 GALR1 (0.39) MAPK1GALR1
SCHEMBL5553512 0.89 MAPK1 (0.39) MAPK1GALR1
SCHEMBL5553495 0.89 MAPK1 (0.34) MAPK1GALR1
SCHEMBL5412214 0.85 TACR1 (0.35) MAPK1
SCHEMBL6819318 0.85 MAPK1 (0.33) MAPK1
SCHEMBL6427958 0.84 GALR1 (0.33) GALR1
SCHEMBL6016949 0.84 SMN1; SMN2 (0.43) MAPK1GALR1
SCHEMBL6429776 0.83 ADRA2A (0.33) GALR1

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 MAPK1 370/4885GALR1 1159/4885

“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.