SCHEMBL20155158

SCHEMBL20155158

Cc1cncc(CCc2cc(CCc3ccnc(C)n3)ncn2)n1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.30
DYRK1A Q13627 1/20 0.30
DYRK1B Q9Y463 1/20 0.30
CYP2D6 P10635 1/20 0.30
HRH1 P35367 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
SCHEMBL24400875 0.91 CYP2D6 (0.33) CDK2DYRK1ADYRK1BCYP2D6HRH1
SCHEMBL21360895 0.82 PDE10A (0.31)
SCHEMBL10834770 0.74 CYP2D6 (0.38) CYP2D6HRH1
SCHEMBL805512 0.67 KDM4E (0.42)
SCHEMBL10835879 0.66 PDE10A (0.32) CYP2D6HRH1
SCHEMBL752089 0.65 KCNH2 (0.57) CYP2D6
SCHEMBL21467096 0.65 KCNH3 (0.35) CDK2DYRK1ADYRK1B
SCHEMBL30480965 0.65 NOS1 (0.39) CYP2D6HRH1
SCHEMBL295055 0.65 NOS1 (0.39) CYP2D6HRH1
SCHEMBL10835851 0.65 CYP1A2 (0.54) CYP2D6HRH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10964893-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-03-30 US disclosed
US-20180138419-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-05-17 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 (2 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-20180138419-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, SLCO4C1 CDK2 1394/4885DYRK1A 4263/4885DYRK1B 4432/4885
US-10964893-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, SLCO4C1 CDK2 1394/4885DYRK1A 4263/4885DYRK1B 4432/4885

“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.