SCHEMBL14500408

SCHEMBL14500408

CN1CCN(c2cc(Cl)cc(Nc3ccnc4[nH]c(C5=CCN(C(=O)OC(C)(C)C)CC5)cc34)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CDK9 P50750 17/20 0.55
▸ CCNT1 O60563 16/20 0.55
▸ TBK1 Q9UHD2 1/20 0.46
▸ APP P05067 1/20 0.44
▸ CNR1 P21554 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
SCHEMBL14500390 0.90 CDK9 (0.55) CDK9CCNT1TBK1
SCHEMBL14500409 0.89 APP (0.45) CDK9CCNT1APP
SCHEMBL14500414 0.89 CDK9 (0.57) CDK9CCNT1TBK1
SCHEMBL14500416 0.88 CDK9 (0.54) CDK9CCNT1TBK1
SCHEMBL5004934 0.87 CDK9 (0.47) CDK9CCNT1TBK1CNR1
SCHEMBL14500415 0.87 CDK9 (0.57) CDK9CCNT1TBK1
SCHEMBL5662093 0.87 CDK9 (0.58) CDK9CCNT1TBK1
SCHEMBL14500418 0.86 CDK9 (0.60) CDK9CCNT1TBK1
SCHEMBL14520938 0.85 CDK9 (0.60) CDK9CCNT1TBK1
SCHEMBL14520253 0.85 CDK9 (0.57) CDK9CCNT1TBK1

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-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds OSI PHARMACEUTICALS, INC. 2007-06-07 — — US disclosed
US-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds OSI PHARMACEUTICALS, INC. 2007-06-07 — — 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-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds BMX, ERBB2, FRK CDK9 392/4885CCNT1 1682/4885TBK1 702/4885

“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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