SCHEMBL13055232

SCHEMBL13055232

CCc1cc(Nc2cnnc(-c3ccc4[nH][nH]c(=O)c4c3)n2)n[nH]1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CCNA1 P78396 1/20 0.34
GRK6 P43250 11/20 0.33
NTRK1 P04629 3/20 0.33
FGFR1 P11362 2/20 0.32
KDR P35968 2/20 0.32
IGF1R P08069 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
AURKA O14965 3/20 0.31
MAP3K5 Q99683 1/20 0.31
CHEK1 O14757 1/20 0.30
DAPK3 O43293 1/20 0.30
JAK2 O60674 1/20 0.30
PRKD3 O94806 1/20 0.30
MAP4K4 O95819 1/20 0.30
PAK4 O96013 1/20 0.30
ABL1 P00519 1/20 0.30
CSF1R P07333 1/20 0.30

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
SCHEMBL13055178 0.78 AURKA (0.38) CCNA2CDK2CCNA1GRK6NTRK1
SCHEMBL13055172 0.77 RET (0.40) AURKARETGSK3AGSK3BAURKB
SCHEMBL805555 0.77 ITK (0.40) CCNA2CDK2CCNA1GRK6NTRK1
SCHEMBL801762 0.76 GRK6 (0.41) GRK6NTRK1IGF1RAURKADAPK3
SCHEMBL13055234 0.74 HCAR3 (0.32) FGFR1KDRIGF1RPRMT5WDR77
SCHEMBL13055231 0.70 AURKA (0.40) NTRK1FGFR1KDRPRMT5WDR77
SCHEMBL801771 0.69 RET (0.40) CCNA2CDK2CCNA1GRK6FGFR1
SCHEMBL13055211 0.68 PDE4B (0.35) FGFR1KDRIGF1R
SCHEMBL13055155 0.68 ABCG2 (0.44) KDRIGF1RMAP4K4ABL1RET
SCHEMBL14423530 0.67 AURKA (0.49) FGFR1KDRIGF1RAURKADAPK3

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.