SCHEMBL3373659

SCHEMBL3373659

N#Cc1cnc2ccc(C=C3SC(NCCc4cccc(F)c4)=NC3=O)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 1/20 0.37
CSNK2A2 P19784 2/20 0.35
CSNK2A1 P68400 2/20 0.35
RPS6KB1 P23443 1/20 0.34
AKT1 P31749 1/20 0.34
CCNC P24863 3/20 0.33
CDK8 P49336 3/20 0.33
CDKN1A P38936 1/20 0.33
CDK19 Q9BWU1 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
NTRK1 P04629 1/20 0.32
NTRK3 Q16288 1/20 0.32
NTRK2 Q16620 1/20 0.32
MEN1 O00255 1/20 0.32
XDH P47989 1/20 0.32
KMT2A Q03164 1/20 0.32
GBA1 P04062 1/20 0.31
NOS1 P29475 2/20 0.31
NOS3 P29474 1/20 0.31
EGLN2 Q96KS0 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
SCHEMBL3373920 1.00 CISD1 (0.37) CISD1CSNK2A2CSNK2A1RPS6KB1AKT1
SCHEMBL14337695 1.00 CISD1 (0.37) CISD1CSNK2A2CSNK2A1RPS6KB1AKT1
SCHEMBL5570153 0.85 CISD1 (0.40) CISD1CSNK2A2CSNK2A1RPS6KB1GPR84
SCHEMBL5570152 0.85 CISD1 (0.40) CISD1CSNK2A2CSNK2A1RPS6KB1GPR84
SCHEMBL3372738 0.81 CISD1 (0.36) CISD1CSNK2A2CSNK2A1RPS6KB1AKT1
SCHEMBL13069005 0.81 CISD1 (0.36) CISD1CSNK2A2CSNK2A1RPS6KB1AKT1
SCHEMBL3372704 0.81 CISD1 (0.36) CISD1CSNK2A2CSNK2A1RPS6KB1AKT1
SCHEMBL3370868 0.80 P2RX7 (0.35) CISD1
SCHEMBL13069299 0.80 P2RX7 (0.35) CISD1
SCHEMBL14337696 0.79 MAP3K8 (0.38) CISD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869036-B1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS HOFFMANN LA ROCHE (CH) 2010-11-03 EP claimed
EP-1869036-A1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS F. Hoffmann-Roche AG (CH) 2007-12-26 EP claimed
US-7304074-B2 Substituted 1,5-naphthyridine azolinones HOFFMANN-LA ROCHE INC. (US) 2007-12-04 US claimed
WO-2006106046-A1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 WO claimed
US-20060223843-A1 Substituted 1,5-naphthyridine azolinones LIU JIN-JUN 2006-10-05 US claimed
EP-1869036-B1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS HOFFMANN LA ROCHE (CH) 2010-11-03 EP disclosed
EP-1869036-A1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS F. Hoffmann-Roche AG (CH) 2007-12-26 EP disclosed
US-7304074-B2 Substituted 1,5-naphthyridine azolinones HOFFMANN-LA ROCHE INC. (US) 2007-12-04 US disclosed
WO-2006106046-A1 SUBSTITUTED 1,5-NAPHTHYRIDINE AZOLIDINONES AS CDK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 WO disclosed
US-20060223843-A1 Substituted 1,5-naphthyridine azolinones LIU JIN-JUN 2006-10-05 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-20060223843-A1 Substituted 1,5-naphthyridine azolinones CDK4, CDK1, CDK14 CISD1 1560/4885CSNK2A2 268/4885CSNK2A1 206/4885

“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.