SCHEMBL8484153

SCHEMBL8484153

O=C1Nc2ccccc2C1=Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 1.00
MAPT P10636 6/20 1.00
SNCA P37840 6/20 1.00
PDGFRB P09619 4/20 0.65
RET P07949 1/20 0.65
FLT3 P36888 1/20 0.65
PLK4 O00444 1/20 0.65
PLK1 P53350 1/20 0.65
KDR P35968 1/20 0.65
METAP1 P53582 1/20 0.64
MEN1 O00255 2/20 0.60
ALDH1A1 P00352 2/20 0.60
MAPK1 P28482 2/20 0.60
KMT2A Q03164 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
CTRC Q99895 2/20 0.60
NPC1 O15118 1/20 0.60
GMNN O75496 1/20 0.60
LMNA P02545 1/20 0.60
HPGD P15428 1/20 0.60

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
SCHEMBL8484149 1.00 APP (1.00) APPMAPTSNCAPDGFRBRET
SCHEMBL16442343 1.00 APP (1.00) APPMAPTSNCAPDGFRBRET
SCHEMBL5470409 0.85 MAPT (0.74) APPMAPTSNCAPLK4PLK1
SCHEMBL5470412 0.85 MAPT (0.74) APPMAPTSNCAPLK4PLK1
SCHEMBL14448894 0.85 MAPT (0.74) APPMAPTSNCAPLK4PLK1
SCHEMBL21751777 0.84 APP (1.00) APPMAPTSNCAMETAP1MEN1
SCHEMBL25837037 0.84 APP (1.00) APPMAPTSNCAMETAP1MEN1
SCHEMBL30482935 0.84 APP (1.00) APPMAPTSNCAMETAP1MEN1
SCHEMBL3757263 0.83 GSK3B (0.74) APPMAPTSNCAPDGFRBRET
SCHEMBL31219496 0.83 GSK3B (0.74) APPMAPTSNCAPDGFRBRET

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
US-5880141-A CONTROLLING, MODULATING AND INHIBITING TYROSINE KINASE SIGNAL TRANSDUCTION SUGEN, INC. (US) 1999-03-09 US claimed
US-5880141-A CONTROLLING, MODULATING AND INHIBITING TYROSINE KINASE SIGNAL TRANSDUCTION SUGEN, INC. (US) 1999-03-09 US disclosed