SCHEMBL15546809

SCHEMBL15546809

Cc1ccc(Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 19/20 0.60
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL15534443 0.89 TNIK (0.75) TNIK
SCHEMBL16699546 0.81 TNIK (0.75) TNIK
SCHEMBL16699517 0.77 TNIK (0.77) TNIK
SCHEMBL16699031 0.76 TNIK (0.62) TNIK
SCHEMBL2367226 0.76 TNIK (0.61) TNIKNPC1ALDH1A1MAPTRAB9A
SCHEMBL16710220 0.75 TNIK (1.00) TNIK
SCHEMBL16698958 0.75 TNIK (0.71) TNIK
SCHEMBL16699999 0.74 TNIK (1.00) TNIK
SCHEMBL16701278 0.73 TNIK (0.79) TNIK
SCHEMBL16699946 0.73 TNIK (0.72) TNIK

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-2855470-A1 NOVEL BICYCLIC THIAZOLE COMPOUNDS Carna Biosciences Inc. (JP) 2015-04-08 EP disclosed
WO-2013176293-A1 NOVEL BICYCLIC THIAZOLE COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2013-11-28 WO disclosed