SCHEMBL13367667

SCHEMBL13367667

COc1ccc(N(C)c2ncncn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.46
PDGFRB P09619 5/20 0.46
KDR P35968 5/20 0.46
TUBB3 Q13509 3/20 0.46
TUBB4A P04350 2/20 0.46
TUBB P07437 2/20 0.46
TUBA3C P0DPH7 2/20 0.46
TUBA1B P68363 2/20 0.46
TUBA4A P68366 2/20 0.46
TUBB4B P68371 2/20 0.46
TUBB2A Q13885 2/20 0.46
TUBB8 Q3ZCM7 2/20 0.46
TUBA3E Q6PEY2 2/20 0.46
TUBA1A Q71U36 2/20 0.46
TUBA1C Q9BQE3 2/20 0.46
TUBB6 Q9BUF5 2/20 0.46
TUBB2B Q9BVA1 2/20 0.46
TUBB1 Q9H4B7 2/20 0.46
MERTK Q12866 1/20 0.44
PDGFRA P16234 1/20 0.42

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
SCHEMBL28569037 0.80 KDM4C (0.32) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL13338817 0.77 EGFR (0.48) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL114319 0.77 CA1 (0.61) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL795930 0.76 EGFR (0.46) EGFRPDGFRBPDGFRACSF1R
Hydrochloric Acid SCHEMBL29089898 0.75 CA1 (0.58) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL5998646 0.75 KDM4E (0.52) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL13367500 0.74 MAPK1 (0.40) EGFRALDH1A1KDM4EMAPTHPGD
SCHEMBL29038976 0.73 ABCG2 (0.40) ALDH1A1CA12CA2CA9CA14
SCHEMBL13367381 0.72 HSP90AA1 (0.38) EGFR
SCHEMBL7468778 0.72 NPC1 (0.62) EGFRPDGFRBKDRTUBB3TUBB4A

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 EGFR 1659/4885PDGFRB 4057/4885KDR 738/4885

“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.