SCHEMBL9805745

SCHEMBL9805745

CNC(=O)N(C)c1ccc([N+](=O)[O-])cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GPR35 Q9HC97 2/20 0.47
GAA P10253 2/20 0.44
TP53 P04637 2/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.42
CXCR1 P25024 2/20 0.42
CXCR2 P25025 2/20 0.42
KCNMA1 Q12791 1/20 0.42
ERN1 O75460 1/20 0.41
PTGES O14684 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL30295546 0.90 L3MBTL1 (0.52) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL10876009 0.80 ALDH1A1 (0.63) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL28566572 0.78 ALDH1A1 (0.49) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL12013087 0.75 ALDH1A1 (0.47) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL22953963 0.74 L3MBTL1 (0.49) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL27587711 0.73 GPR35 (0.51) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL28462224 0.73 ALDH1A1 (0.53) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL8013482 0.73 CXCR1 (0.58) L3MBTL1GPR35GAAHPGDHTT
SCHEMBL1678369 0.72 GPR35 (0.50) ALDH1A1L3MBTL1GPR35GAATP53
SCHEMBL20494421 0.72 L3MBTL1 (0.56) ALDH1A1L3MBTL1GPR35GAATP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10061151-B2 Light shielding material and display device including the same LG DISPLAY CO., LTD. (KR) 2018-08-28 US disclosed
US-20150378182-A1 LIGHT SHIELDING MATERIAL AND DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2015-12-31 US disclosed
US-5032488-A Method of metalizing a surface using a mixture of olefin and dibenzalacetone palladium complex CIBA-GEIGY CORPORATION (US) 1991-07-16 US disclosed