SCHEMBL16623523

SCHEMBL16623523

N=C(c1csc(C(N)=O)c1)c1c(N)cc[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
EGFR P00533 1/20 0.32
CHEK1 O14757 1/20 0.30

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
SCHEMBL16726667 0.80 HPGD (0.31) HPGDHTT
SCHEMBL16726671 0.78 HPGD (0.34) HPGDHTT
SCHEMBL16623551 0.78 JAK1 (0.34)
SCHEMBL16623474 0.77 HSP90AA1 (0.35)
SCHEMBL17849195 0.77 HSP90AA1 (0.35)
SCHEMBL16623491 0.77 JAK1 (0.34)
SCHEMBL16623536 0.77 HSP90AA1 (0.35)
SCHEMBL16726647 0.77
SCHEMBL16623472 0.76 JAK1 (0.33)
SCHEMBL16623510 0.76 JAK1 (0.42)

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
EP-2857400-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-04-08 EP disclosed