SCHEMBL13993635

SCHEMBL13993635

O=C(Nc1ccc(OCCO)nc1)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CDK14 O94921 8/20 0.52
▸ CCNY Q8ND76 8/20 0.52
▸ POLB P06746 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ABL1 P00519 1/20 0.40
▸ SRC P12931 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ JAK2 O60674 2/20 0.39
▸ TYK2 P29597 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ TRPV1 Q8NER1 4/20 0.38

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
SCHEMBL8261466 0.91 CDK14 (0.54) CDK14CCNYPOLBSMN1; SMN2ABL1
SCHEMBL959301 0.87 POLB (0.56) CDK14CCNYPOLBSMN1; SMN2ABL1
SCHEMBL954966 0.84 CDK14 (0.55) CDK14CCNYABL1SRCHPGD
SCHEMBL13993632 0.83 CDK14 (0.56) CDK14CCNYPOLBABL1SRC
SCHEMBL957511 0.83 CDK14 (0.54) CDK14CCNYABL1SRCHPGD
SCHEMBL16995305 0.81 POLB (0.52) CDK14CCNYPOLBSMN1; SMN2JAK1
SCHEMBL13993605 0.81 CDK14 (0.47) CDK14CCNY
SCHEMBL22235847 0.80 MEN1 (0.42) —
SCHEMBL8261470 0.79 CDK14 (0.53) CDK14CCNYPOLBSMN1; SMN2ABL1
SCHEMBL1286749 0.78 CDK14 (0.53) CDK14CCNYJAK2TYK2CYP3A4

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 2 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

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 51/4885POLB 1022/4885

“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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