SCHEMBL3397313

SCHEMBL3397313

NC(=O)c1nc(Nc2cccnc2)sc1NC(=O)c1ccc(NCCN2CCCCC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 19/20 0.75
TBK1 Q9UHD2 1/20 0.49

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
SCHEMBL3397644 0.90 TNIK (0.77) TNIKTBK1
SCHEMBL3393595 0.86 TNIK (0.72) TNIK
SCHEMBL16699019 0.86 TNIK (1.00) TNIK
SCHEMBL3392237 0.84 TNIK (0.76) TNIK
SCHEMBL3394878 0.83 TNIK (0.75) TNIK
SCHEMBL3396750 0.83 TNIK (0.57) TNIK
SCHEMBL3397542 0.83 TNIK (0.73) TNIKTBK1
SCHEMBL3392639 0.81 TNIK (0.62) TNIK
SCHEMBL3397651 0.81 TNIK (0.73) TNIKTBK1
SCHEMBL3393673 0.80 TNIK (0.67) TNIKTBK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2364149-B1 TNIK INHIBITOR AND THE USE NAT CANCER CT (JP) 2014-05-07 EP disclosed
US-20100216795-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-08-26 US disclosed
US-20100216795-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-08-26 US disclosed
US-20100216795-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-08-26 US disclosed
WO-2010064111-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI (JP) 2010-06-10 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-20100216795-A1 TNIK INHIBITOR AND THE USE TNIK, TNNI3K, TNK1 TNIK 1/4885TBK1 128/4885

“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.