SCHEMBL16631527

SCHEMBL16631527

CCc1cc2cc(C)c[nH]c-2nc1=S

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR1I3 Q14994 1/20 0.33
HMBS P08397 1/20 0.32
DAO P14920 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
SCHEMBL16631495 0.82 DAO (0.34) KMT2AMAPTHMBSDAO
SCHEMBL18081934 0.80 HMBS (0.37) NR1I3HMBS
SCHEMBL16631414 0.74 NR1I3 (0.35) MAPTRXFP1NR1I3
SCHEMBL18080485 0.74 NR1I3 (0.33) NR1I3HMBS
SCHEMBL16631553 0.73 KMT2A (0.33) KMT2A
SCHEMBL16631709 0.71 NR1I3 (0.41) KMT2AMAPTRXFP1NR1I3
SCHEMBL16631705 0.70 TNKS (0.33) MAPT
SCHEMBL18081761 0.69 DAO (0.37) HMBSDAO
SCHEMBL16631682 0.69 KMT2A (0.33) KMT2AMAPTRXFP1
SCHEMBL16631922 0.65 L3MBTL1 (0.35) KMT2AMAPTRXFP1

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