SCHEMBL6508775

SCHEMBL6508775

NC(=O)C(c1cccnc1)c1cccc(-c2n[nH]c3ccc(-c4cnn[nH]4)cc23)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.43
MAP3K5 Q99683 2/20 0.42
DYRK1A Q13627 12/20 0.41
CLK3 P49761 8/20 0.41
CLK2 P49760 7/20 0.41
CDK7 P50613 1/20 0.41
MAP2K4 P45985 2/20 0.40
WNT1 P04628 3/20 0.39

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
SCHEMBL6501695 0.88 MAP3K5 (0.40) MAP3K5DYRK1ACLK3CLK2MAP2K4
SCHEMBL5380936 0.82 MAP3K5 (0.51) PIM1MAP3K5DYRK1ACLK3CLK2
SCHEMBL6507804 0.78 TTK (0.43) MAP3K5DYRK1ACLK3CLK2MAP2K4
SCHEMBL6509704 0.73 MAP2K4 (0.45) PIM1MAP3K5DYRK1AMAP2K4
SCHEMBL5375071 0.69 MAP3K5 (0.51) MAP3K5DYRK1ACLK2MAP2K4WNT1
SCHEMBL6502512 0.69 MAP2K4 (0.41) MAP3K5DYRK1ACLK2MAP2K4
SCHEMBL362393 0.69 F7 (0.52)
SCHEMBL17594113 0.67 ROCK2 (0.44) PIM1
SCHEMBL3057993 0.67 MKNK1 (0.50)
SCHEMBL5380038 0.65 MAPK1 (0.46) MAP2K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 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-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R PIM1 172/4885MAP3K5 32/4885DYRK1A 426/4885

“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.