SCHEMBL8569894

SCHEMBL8569894

CNC(=O)c1nc2ccccc2c(OC)c1C

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.51
MAPT P10636 3/20 0.49
HTT P42858 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
DHODH Q02127 1/20 0.44
TACR3 P29371 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GLA P06280 1/20 0.43
YTHDC1 Q96MU7 1/20 0.42
PLK1 P53350 1/20 0.42

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
SCHEMBL23197837 0.84 POLB (0.56) POLBMAPTHTTMEN1KMT2A
SCHEMBL30211256 0.79 POLB (0.46) POLBMAPTKDM4EGAAADORA3
SCHEMBL7946300 0.79 PDCD1 (0.40) MAPTHTTKDM4EALDH1A1DHODH
SCHEMBL23197838 0.79 POLB (0.50) POLBMAPTHTTMEN1KMT2A
SCHEMBL752046 0.75 POLB (0.53) POLBMAPTKDM4EGAAALDH1A1
SCHEMBL28674515 0.74 PLK1 (0.44) POLBMAPTHTTKDM4EGAA
SCHEMBL23197722 0.73 POLB (0.63) POLBMAPTHTTMEN1KMT2A
SCHEMBL17921816 0.73 POLB (0.50) POLBMAPTKDM4EGAAALDH1A1
SCHEMBL23999688 0.73 POLB (0.68) POLBMAPTHTTMEN1KMT2A
SCHEMBL16098313 0.72 TACR3 (0.73) DHODHTACR3

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
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US claimed