SCHEMBL9923076

SCHEMBL9923076

Cc1ccccc1Nc1c(C#N)cnn2c(N=O)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 3/20 0.36
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
GLA P06280 1/20 0.36
MAPK1 P28482 1/20 0.36
MAP2K1 Q02750 3/20 0.35
PABPC1 P11940 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
PRKCQ Q04759 1/20 0.34
PRKCD Q05655 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
DYRK3 O43781 1/20 0.33
CSNK2A2 P19784 1/20 0.33

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
SCHEMBL9923337 0.83 CSNK2A1 (0.46) CSNK2A1MAP2K1
SCHEMBL9923079 0.80 CSF1R (0.45) PABPC1KMT2ALMNA
SCHEMBL12875305 0.80 MAPT (0.39) CSNK2A1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9923397 0.77 MAP2K1 (0.39) MAP2K1LMNA
SCHEMBL9923334 0.74 JAK1 (0.42) CSNK2A1KDM4EALDH1A1KMT2AMEN1
SCHEMBL9923433 0.72 JAK1 (0.35) CSNK2A1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9923432 0.72 KDM4E (0.35) CSNK2A1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9923437 0.72 KDM4D (0.33) CSNK2A1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL12875307 0.69 MAPT (0.40) ALDH1A1HPGDMAP2K1KMT2AMEN1
SCHEMBL9920270 0.64 CSF1R (0.48) MAP2K1LMNACLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors JAK1, JAK2, JAK3 CSNK2A1 393/4885KDM4E 449/4885ALDH1A1 1632/4885

“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.