SCHEMBL4397568

SCHEMBL4397568

O=C(Nc1ccc(F)c([N+](=O)[O-])c1)Oc1cc(=O)oc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.51
KMT2A Q03164 9/20 0.51
LMNA P02545 6/20 0.51
MAPT P10636 5/20 0.51
HTT P42858 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 4/20 0.48
TRPV1 Q8NER1 1/20 0.47
MCL1 Q07820 1/20 0.46
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PTGS2 P35354 1/20 0.43
NPSR1 Q6W5P4 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
SCHEMBL4381248 0.77 KMT2A (0.53) MEN1KMT2ALMNAMAPTHTT
SCHEMBL4386516 0.74 RXFP1 (0.57) MEN1KMT2ALMNAALDH1A1L3MBTL1
SCHEMBL1496819 0.73 KMT2A (0.55) MEN1KMT2ALMNAMAPTHTT
SCHEMBL29780113 0.72 LMNA (0.63) MEN1KMT2ALMNAMAPTHTT
SCHEMBL5881545 0.72 LMNA (0.63) MEN1KMT2ALMNAMAPTHTT
SCHEMBL18812865 0.69 LMNA (0.65) MEN1KMT2ALMNAMAPTHTT
SCHEMBL29463677 0.69 LMNA (0.65) MEN1KMT2ALMNAMAPTHTT
SCHEMBL6813819 0.69 LMNA (1.00) MEN1KMT2ALMNAMAPTHTT
SCHEMBL29537831 0.68 LMNA (0.58) MEN1KMT2ALMNAMAPTHTT
SCHEMBL1885546 0.68 LMNA (0.58) MEN1KMT2ALMNAMAPTHTT

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-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed