SCHEMBL13367381

SCHEMBL13367381

CN(c1ncncn1)c1ncncn1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.38
EGFR P00533 2/20 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
SCHEMBL4720221 0.81
Hydrochloric Acid SCHEMBL28946229 0.79 HSD17B10 (0.40) HSP90AA1EGFR
SCHEMBL795930 0.78 EGFR (0.46) EGFR
SCHEMBL27566165 0.77
SCHEMBL4722438 0.73 ACACB (0.33) HSP90AA1
SCHEMBL13367500 0.72 MAPK1 (0.40) EGFR
SCHEMBL13367667 0.72 EGFR (0.46) EGFR
SCHEMBL2103000 0.71 HSP90AA1 (0.31) HSP90AA1
SCHEMBL18155167 0.71 HSP90AA1 (0.35) HSP90AA1
SCHEMBL4765198 0.69 HCAR3 (0.36)

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-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-05-06 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-20100108997-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OR10J3, OCIAD1, OCIAD2 HSP90AA1 4612/4885EGFR 1659/4885

“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.