SCHEMBL9923288

SCHEMBL9923288

N#Cc1cnn2ccnc2c1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.60
KDM4E B2RXH2 6/20 0.39
KDM4D Q6B0I6 1/20 0.39
ALDH1A1 P00352 5/20 0.38
CLK4 Q9HAZ1 2/20 0.38
HPGD P15428 1/20 0.38
SMPD3 Q9NY59 2/20 0.36
AXL P30530 1/20 0.36
TGFBR1 P36897 3/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
HTR2A P28223 1/20 0.33
DRD3 P35462 1/20 0.33
ADRA1A P35348 2/20 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
SCHEMBL9923287 0.79 CDK2 (0.60) CDK2KDM4EKDM4DALDH1A1CLK4
SCHEMBL18343004 0.79 CDK2 (0.60) CDK2KDM4EKDM4DALDH1A1CLK4
SCHEMBL10437263 0.76 SMPD3 (0.41) CDK2KDM4EALDH1A1SMPD3AXL
SCHEMBL4473978 0.75 CDK2 (1.00) CDK2KDM4EKDM4DALDH1A1CLK4
Hydrochloric Acid SCHEMBL30375382 0.74 CDK2 (0.96) CDK2KDM4EKDM4DALDH1A1CLK4
SCHEMBL30549535 0.73 CDK2 (0.61) CDK2KDM4EKDM4DALDH1A1CLK4
SCHEMBL9923344 0.72 CDK2 (0.40) CDK2KDM4EALDH1A1LMNAPOLB
SCHEMBL1160390 0.70 CDK2 (0.49) CDK2KDM4EKDM4DALDH1A1HPGD
SCHEMBL9923348 0.70 CDK2 (0.38) CDK2KDM4EKDM4DALDH1A1CLK4
SCHEMBL3019931 0.69 PIK3CG (0.45) CDK2KDM4EALDH1A1HPGDLMNA

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 CDK2 423/4885KDM4E 449/4885KDM4D 1040/4885

“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.