SCHEMBL2367246

SCHEMBL2367246

CC(C)CC(=O)Nc1sc(Nc2ccccc2)nc1C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 12/20 0.65
MAPT P10636 5/20 0.61
LMNA P02545 3/20 0.61
TP53 P04637 2/20 0.61
POLB P06746 1/20 0.61
PIP5K1C O60331 1/20 0.57
HPGD P15428 1/20 0.54
KMT2A Q03164 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
SCHEMBL16699001 0.88 TNIK (0.68) TNIK
SCHEMBL13224732 0.81 TNIK (0.84) TNIKMAPTLMNATP53POLB
SCHEMBL2366947 0.79 MAPT (0.56) TNIKMAPTLMNATP53POLB
SCHEMBL3393555 0.79 MAPT (0.75) TNIKMAPTLMNATP53POLB
SCHEMBL3393548 0.79 TNIK (1.00) TNIKMAPTLMNATP53POLB
SCHEMBL2367283 0.78 PIP5K1C (0.69) TNIKMAPTLMNATP53POLB
SCHEMBL2366826 0.77 TNIK (0.80) TNIKMAPTLMNATP53POLB
SCHEMBL2366210 0.76 MAPT (0.79) TNIKMAPTLMNATP53POLB
SCHEMBL3394594 0.76 TNIK (0.79) TNIKMAPTLMNATP53POLB
SCHEMBL3395759 0.76 TNIK (0.79) TNIKMAPTLMNATP53POLB

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
EP-2364149-B1 TNIK INHIBITOR AND THE USE NAT CANCER CT (JP) 2014-05-07 EP disclosed
CN-102227218-A Tnik inhibitor and use thereof TESSHI YAMADA 2011-10-26 CN disclosed
EP-2364149-A1 TNIK INHIBITOR AND THE USE National Cancer Center (JP) 2011-09-14 EP 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
US-20100137386-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-06-03 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 (2 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 1/4885MAPT 3204/4885LMNA 4362/4885
US-20100137386-A1 TNIK INHIBITOR AND THE USE TNIK, TNNI3K, TNK1 TNIK 1/4885MAPT 2295/4885LMNA 4645/4885

“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.