SCHEMBL13055419

SCHEMBL13055419

O=c1[nH][nH]c2ccc(C3CCC(Nc4cc(C5CC5)[nH]n4)C3)cc12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 12/20 0.38
▸ CDK2 P24941 12/20 0.38
▸ CCNA1 P78396 12/20 0.38
▸ PAK4 O96013 1/20 0.36
▸ PAK1 Q13153 1/20 0.36
▸ CDK7 P50613 3/20 0.36
▸ CDK13 Q14004 3/20 0.36
▸ CDK12 Q9NYV4 3/20 0.36
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34

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
SCHEMBL13055407 0.96 CDK2 (0.38) CCNA2CDK2CCNA1PRMT5WDR77
SCHEMBL13055417 0.89 PRMT5 (0.37) CCNA2CDK2CCNA1PAK4PAK1
SCHEMBL13055425 0.80 NOS2 (0.35) CDK2
SCHEMBL13055303 0.80 CCNA2 (0.38) CCNA2CDK2CCNA1PAK4PAK1
SCHEMBL13055421 0.78 ITK (0.35) PAK4CDK7PRMT5WDR77
SCHEMBL13055283 0.77 AR (0.41) CCNA2CDK2CCNA1
SCHEMBL13055361 0.77 CCNA2 (0.39) CCNA2CDK2CCNA1PAK4PAK1
SCHEMBL13055413 0.77 KDM4E (0.37) CDK2PRMT5WDR77
SCHEMBL13055339 0.76 CCNA2 (0.35) CCNA2CDK2CCNA1PAK4PAK1
SCHEMBL13055427 0.75 AURKA (0.32) PAK4CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842712-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 — — US disclosed
US-7842712-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 — — US disclosed
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-02-19 — — US disclosed
US-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-02-19 — — US disclosed
US-7262200-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-28 — — US disclosed
US-7262200-B2 Indazolinone compositions useful as kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-28 — — 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-20090048250-A1 INDAZOLINONE COMPOSITIONS USEFUL AS KINASE INHIBITORS LCK, CDK2, MKNK2 CCNA2 333/4885CDK2 2/4885CCNA1 533/4885

“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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