SCHEMBL8263999

SCHEMBL8263999

COc1cccc(Cl)c1C(=O)Nc1c[nH]nc1C(=O)NC1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CDK14 O94921 13/20 0.52
▸ CCNY Q8ND76 12/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GLA P06280 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.43
▸ HSP90AB1 P08238 1/20 0.43
▸ PDK1 Q15118 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ HTR4 Q13639 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CNR1 P21554 1/20 0.42

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
SCHEMBL2029686 0.93 CDK14 (0.48) CDK14CCNYCDK1CDK4CCND1
SCHEMBL8264010 0.90 GLA (0.45) CDK14CCNYSMN1; SMN2GLATSHR
SCHEMBL8261463 0.90 CDK2 (0.52) CDK14CCNYSMN1; SMN2GLATSHR
SCHEMBL13993660 0.90 LMNA (0.46) CDK14CCNYCDK1CDK4CCND1
SCHEMBL8262596 0.89 CDK14 (0.43) CDK14CCNYHSP90AA1HSP90AB1PDK1
SCHEMBL8261492 0.89 CDK2 (0.49) CDK14CCNYSMN1; SMN2TSHRCDK1
SCHEMBL8261512 0.88 CDK14 (0.44) CDK14CCNYHSP90AA1HSP90AB1PDK1
SCHEMBL13993685 0.88 HSP90AA1 (0.44) CDK14CCNYSMN1; SMN2HSP90AA1HSP90AB1
SCHEMBL8261500 0.87 CDK14 (0.43) CDK14CCNYHSP90AA1HSP90AB1PDK1
SCHEMBL13993606 0.86 CDK14 (0.46) CDK14CCNYCDK1CDK4CCND1

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 51/4885SMN1; SMN2 3655/4885

“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.

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