SCHEMBL5573335

SCHEMBL5573335

Cc1cccc(Cl)c1CNC1=NC(=O)C(=Cc2ccc3ncccc3n2)S1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.35
SRC P12931 1/20 0.35
CYP3A4 P08684 1/20 0.33
CD38 P28907 1/20 0.33
P2RX7 Q99572 4/20 0.32
TRPM5 Q9NZQ8 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
JAK2 O60674 2/20 0.31
JAK3 P52333 2/20 0.31
CISD1 Q9NZ45 1/20 0.31
SCN1A P35498 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN8A Q9UQD0 1/20 0.31
DYRK3 O43781 1/20 0.31
JAK1 P23458 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NSD2 O96028 1/20 0.30
POLB P06746 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
SCHEMBL5573333 1.00 ABL1 (0.35) ABL1SRCCYP3A4CD38P2RX7
SCHEMBL5573274 0.85 ALDH1A1 (0.37) CYP3A4MEN1KMT2AALDH1A1DYRK3
SCHEMBL5571290 0.85 ALDH1A1 (0.37) CYP3A4MEN1KMT2AALDH1A1DYRK3
SCHEMBL3371539 0.84 ABL1 (0.35) ABL1SRCCYP3A4CD38JAK2
SCHEMBL3370583 0.84 ABL1 (0.35) ABL1SRCCYP3A4CD38JAK2
SCHEMBL13068955 0.84 ABL1 (0.35) ABL1SRCCYP3A4CD38JAK2
SCHEMBL5573813 0.81 ALDH1A1 (0.34) TRPM5MEN1KMT2AALDH1A1KDM4E
SCHEMBL5573809 0.81 ALDH1A1 (0.34) TRPM5MEN1KMT2AALDH1A1KDM4E
SCHEMBL5571291 0.80 GRM4 (0.41) P2RX7TRPM5MEN1KMT2ACISD1
SCHEMBL5571297 0.80 GRM4 (0.41) P2RX7TRPM5MEN1KMT2ACISD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7268231-B2 1,5-Naphthyridine azolinone HOFFMANN-LA ROCHE INC. (US) 2007-09-11 US claimed
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 ABL1 319/4885SRC 1307/4885CYP3A4 1790/4885

“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.