SCHEMBL8261502

SCHEMBL8261502

O=C(Nc1cncnc1)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CDK14 O94921 8/20 0.55
▸ CCNY Q8ND76 8/20 0.55
▸ MAPK7 Q13164 1/20 0.49
▸ TYK2 P29597 6/20 0.49
▸ JAK1 P23458 5/20 0.49
▸ JAK2 O60674 4/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ HPGD P15428 1/20 0.43
▸ PDE10A Q9Y233 1/20 0.42
▸ BCAT2 O15382 1/20 0.42
▸ ABL1 P00519 1/20 0.41
▸ SRC P12931 1/20 0.41

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
SCHEMBL1286749 0.88 CDK14 (0.53) CDK14CCNYMAPK7TYK2JAK1
SCHEMBL8212885 0.87 TYK2 (0.68) CDK14CCNYMAPK7TYK2JAK1
SCHEMBL954966 0.84 CDK14 (0.55) CDK14CCNYTYK2JAK1JAK2
SCHEMBL957511 0.82 CDK14 (0.54) CDK14CCNYTYK2JAK1JAK2
SCHEMBL13993632 0.82 CDK14 (0.56) CDK14CCNYTYK2JAK1JAK2
SCHEMBL954955 0.81 KMT2A (0.51) CDK14CCNYMAPK7TYK2JAK1
SCHEMBL8260751 0.81 CDK14 (0.51) CDK14CCNYTYK2JAK1JAK2
SCHEMBL23271061 0.81 CDK14 (0.65) CDK14CCNYTYK2JAK1JAK2
SCHEMBL13993636 0.81 JAK2 (0.54) CDK14CCNYTYK2JAK1JAK2
SCHEMBL959301 0.80 POLB (0.56) CDK14CCNYABL1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S ASTEX THERAPEUTICS LIMITED (UK) 2008-12-11 — — US disclosed
US-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S ASTEX THERAPEUTICS LIMITED (UK) 2008-12-11 — — US disclosed
WO-2006077414-A1 PYRAZOLE DERIVATIVES FOR THE INHIBITION OF CDK' S AND GSK' S ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 — — WO 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-20080306069-A1 Pyrazole Derivatives for the Inhibition of CDK'S and GSK'S GSK3A, CDK11A, CDK1 CDK14 8/4885CCNY 51/4885MAPK7 1085/4885

“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.

Send feedback