SCHEMBL5573825

SCHEMBL5573825

Cc1ccccc1CNC1=NC(=O)C(=Cc2ccc3ncccc3n2)N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
MAP4K4 O95819 1/20 0.35
TRPM5 Q9NZQ8 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
HCRTR2 O43614 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
LMNA P02545 1/20 0.33
HIF1A Q16665 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
BRD4 O60885 2/20 0.32
BRD9 Q9H8M2 1/20 0.32
ABL1 P00519 1/20 0.32
SRC P12931 1/20 0.32
HPGD P15428 1/20 0.31
KAT2B Q92831 1/20 0.31
ASAH1 Q13510 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
SCHEMBL5573823 1.00 ELANE (0.40) ELANEMAP4K4TRPM5HTR2AHTR2C
SCHEMBL5629675 0.90 DYRK3 (0.34) ELANETRPM5MEN1KMT2AALDH1A1
SCHEMBL5574027 0.90 DYRK3 (0.34) ELANETRPM5MEN1KMT2AALDH1A1
SCHEMBL5571296 0.88 ALDH1A1 (0.36) MAP4K4HTR2AHTR2CHTR2BLMNA
SCHEMBL5573841 0.88 ALDH1A1 (0.36) MAP4K4HTR2AHTR2CHTR2BLMNA
SCHEMBL5574640 0.88 KDM4E (0.39) HTR2AHTR2CHTR2BLMNAHIF1A
SCHEMBL5573751 0.86 APP (0.36) LMNAMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL5573752 0.86 APP (0.36) LMNAMEN1KMT2AHPGDSMN1; SMN2
SCHEMBL5571285 0.86 GSK3B (0.38) MAP4K4HCRTR2LMNAABL1SRC
SCHEMBL5571288 0.86 GSK3B (0.38) MAP4K4HCRTR2LMNAABL1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1805174-A1 1,5-NAPHTHYRIDINE AZOLIDINONES HAVING CDK1 ANTIPROLIFERATIVE ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 2007-07-11 EP claimed
WO-2006040052-A1 1,5-NAPHTHYRIDINE AZOLIDINONES HAVING CDK1 ANTIPROLIFERATIVE ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2006-04-20 WO claimed
US-20060084673-A1 1,5-naphthyridine azolinone LIU JIN-JUN 2006-04-20 US claimed
US-7268231-B2 1,5-Naphthyridine azolinone HOFFMANN-LA ROCHE INC. (US) 2007-09-11 US disclosed
EP-1805174-A1 1,5-NAPHTHYRIDINE AZOLIDINONES HAVING CDK1 ANTIPROLIFERATIVE ACTIVITY F.HOFFMANN-LA ROCHE AG (CH) 2007-07-11 EP disclosed
WO-2006040052-A1 1,5-NAPHTHYRIDINE AZOLIDINONES HAVING CDK1 ANTIPROLIFERATIVE ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2006-04-20 WO disclosed
US-20060084673-A1 1,5-naphthyridine azolinone LIU JIN-JUN 2006-04-20 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-20060084673-A1 1,5-naphthyridine azolinone CDK1, CDK15, CDK14 ELANE 3163/4885MAP4K4 162/4885TRPM5 4114/4885

“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.