SCHEMBL4308629

SCHEMBL4308629

CCCC(=O)Nc1c[nH]c2ncc(-c3cccc(N)c3)cc12

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIT P10721 8/20 0.57
NTRK1 P04629 6/20 0.55
PIK3CA P42336 3/20 0.54
DYRK1A Q13627 1/20 0.54
AAK1 Q2M2I8 4/20 0.52
BTK Q06187 1/20 0.49
ITK Q08881 1/20 0.49
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAP4K1 Q92918 1/20 0.48

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
SCHEMBL7117296 0.88 AAK1 (0.65) KITAAK1BTKITKGSK3A
SCHEMBL7114155 0.88 GSK3A (0.62) KITAAK1BTKITKGSK3A
SCHEMBL7116485 0.88 AAK1 (0.60) AAK1GSK3AGSK3B
SCHEMBL7117585 0.87 AXL (0.61) NTRK1DYRK1AAAK1BTKITK
SCHEMBL7051030 0.87 ADORA1 (0.53) AAK1BTKITKGSK3AGSK3B
SCHEMBL7116630 0.86 AAK1 (0.56) NTRK1DYRK1AAAK1BTKITK
SCHEMBL7118372 0.85 CAMKK2 (0.50) DYRK1AAAK1BTKITKGSK3A
SCHEMBL7118788 0.85 AAK1 (0.58) NTRK1DYRK1AAAK1BTKITK
SCHEMBL4301384 0.85 NTRK1 (0.62) KITNTRK1AAK1BTKITK
SCHEMBL7116088 0.83 SGK1 (0.54) AAK1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003028724-A1 CHK1 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-04-10 WO claimed
US-20090306126-A1 Indole Derivatives ASTRAZENECA AB (SE) 2009-12-10 US disclosed
CN-101448827-A Indole derivatives ASTRAZENECA AB (SE) 2009-06-03 CN disclosed
WO-2003028724-A1 CHK1 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-04-10 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-20090306126-A1 Indole Derivatives MTOR, IDO1, AKT1S1 KIT 322/4885NTRK1 942/4885PIK3CA 27/4885

“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.