SCHEMBL2366746

SCHEMBL2366746

CCCCN(C(=O)O)c1ccc(Nc2nc(C(N)=O)c(NC(=O)c3ccc(NC(C)=O)cc3)s2)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
TP53 P04637 1/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 1/20 0.59
TNIK Q9UKE5 19/20 0.59

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
SCHEMBL2367333 0.84 TNIK (0.80) LMNATP53POLBMAPTTNIK
SCHEMBL3397653 0.83 LMNA (0.80) LMNATP53POLBMAPTTNIK
SCHEMBL3394772 0.83 MAPT (0.64) LMNATP53POLBMAPTTNIK
SCHEMBL2366826 0.82 TNIK (0.80) LMNATP53POLBMAPTTNIK
SCHEMBL2366920 0.80 TNIK (0.79) LMNATP53POLBMAPTTNIK
SCHEMBL3393628 0.80 TNIK (0.74) LMNATP53POLBMAPTTNIK
SCHEMBL2366092 0.80 TNIK (0.74) LMNATP53POLBMAPTTNIK
SCHEMBL2367264 0.79 TNIK (0.72) LMNATP53POLBMAPTTNIK
SCHEMBL3394962 0.79 TNIK (0.72) LMNATP53POLBMAPTTNIK
SCHEMBL3394616 0.77 TNIK (0.70) LMNATP53POLBMAPTTNIK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2364149-A1 TNIK INHIBITOR AND THE USE National Cancer Center (JP) 2011-09-14 EP disclosed
WO-2010064111-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI (JP) 2010-06-10 WO disclosed