SCHEMBL11429809

SCHEMBL11429809

[CH]=CC=Cc1ccc([N+](=O)[O-])o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.58
TDP1 Q9NUW8 5/20 0.58
POLB P06746 5/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 6/20 0.56
KDM4E B2RXH2 4/20 0.56
MAPT P10636 4/20 0.56
NPSR1 Q6W5P4 3/20 0.56
ALDH1A1 P00352 3/20 0.56
LMNA P02545 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
MITF O75030 1/20 0.56
XBP1 P17861 1/20 0.56
SLC2A1 P11166 1/20 0.52
CASP6 P55212 3/20 0.51
CCR6 P51684 1/20 0.51
HTT P42858 4/20 0.50
MAPK1 P28482 2/20 0.50

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
SCHEMBL291297 0.84 KMT2A (0.60) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL1957446 0.84 KMT2A (0.60) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL258449 0.81 TDP1 (0.63) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL26178930 0.78 KMT2A (0.56) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL10683254 0.78 KMT2A (0.56) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL7206975 0.78 KMT2A (0.62) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL17975323 0.78 KMT2A (0.62) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL11360894 0.78 KMT2A (0.62) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL15978028 0.78 KMT2A (0.62) KMT2ATDP1POLBL3MBTL1MEN1
SCHEMBL11360897 0.78 KMT2A (0.62) KMT2ATDP1POLBL3MBTL1MEN1

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-4201784-A ANTITUMOR INSTITUT ORGANICHESKOGO SINTEZA AKADEMII NAUK LATVIISKOI SSR (SU) 1980-05-06 US disclosed