SCHEMBL27361882

SCHEMBL27361882

Nc1cnc(-c2c[nH]c3ccccc23)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 2/20 0.59
CDK5 Q00535 2/20 0.59
CDK5R1 Q15078 2/20 0.59
GSK3B P49841 1/20 0.59
DYRK1A Q13627 1/20 0.59
MAP3K14 Q99558 1/20 0.59
ALDH1A1 P00352 4/20 0.56
MAPT P10636 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
KDM4E B2RXH2 3/20 0.56
HSD17B10 Q99714 2/20 0.56
RAB9A P51151 2/20 0.56
THRB P10828 2/20 0.56
ALOX15 P16050 1/20 0.56
PPARG P37231 1/20 0.56
NCOA2 Q15596 1/20 0.56
HTT P42858 1/20 0.50
PDGFRB P09619 2/20 0.48

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
SCHEMBL20017671 0.91 CLK1 (0.58) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL27362019 0.78 PDPK1 (0.62) CDK5CDK5R1GSK3BDYRK1APIM1
SCHEMBL31063685 0.78 MAPT (0.54) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL23064176 0.77 HSD17B10 (0.56) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL18418495 0.75 MEN1 (0.53) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL17179288 0.75 NR4A2 (0.58) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL4398433 0.75 MAPT (0.62) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL573402 0.74 GSK3B (1.00) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL29488162 0.74 GSK3B (1.00) CLK1CDK5CDK5R1GSK3BDYRK1A
SCHEMBL3618586 0.74 CLK1 (0.52) CLK1CDK5CDK5R1GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260016473-A1 REAGENT FOR DETECTING SARS-RELATED CORONAVIRUS AIST (JP) 2026-01-15 US disclosed
WO-2024014536-A1 REAGENT FOR DETECTING SARS-RELATED CORONAVIRUS 国立研究開発法人産業技術総合研究所 2024-01-18 WO disclosed
WO-2024014536-A1 REAGENT FOR DETECTING SARS-RELATED CORONAVIRUS 国立研究開発法人産業技術総合研究所 2024-01-18 WO 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-20260016473-A1 REAGENT FOR DETECTING SARS-RELATED CORONAVIRUS SARS1, CYP2F1, CYP7A1 CLK1 4301/4885CDK5 4021/4885CDK5R1 3592/4885

“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.