SCHEMBL16631927

SCHEMBL16631927

CCn1cc2nc(C)c(=O)[nH]c2nc1=S

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.33
CASP6 P55212 1/20 0.33
ADORA3 P0DMS8 3/20 0.32
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL16631928 0.84 ADORA3 (0.31) ADORA3
SCHEMBL18081943 0.80 NSD2 (0.36) NSD2CASP6HPGDSMN1; SMN2
SCHEMBL18080527 0.77 SMN1; SMN2 (0.34) NSD2CASP6HPGDSMN1; SMN2
SCHEMBL18081945 0.70 LMNA (0.32) NSD2CASP6HPGDSMN1; SMN2
SCHEMBL16631759 0.68 KMT2A (0.32)
SCHEMBL18080236 0.68 PYGM (0.47) HPGDHTT
SCHEMBL16631887 0.67 LMNA (0.46) ADORA3SMN1; SMN2
SCHEMBL18080523 0.67 LMNA (0.33) SMN1; SMN2
SCHEMBL16631754 0.67 MEN1 (0.33)
SCHEMBL16631362 0.66 KDM4E (0.33)

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
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed