SCHEMBL6896028

SCHEMBL6896028

O=C(O)Oc1ccc([N+](=O)[O-])c(Cc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 1/20 0.41
POLB P06746 3/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
GAA P10253 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RECQL P46063 1/20 0.36
HPSE Q9Y251 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL5703441 0.83 NCEH1 (0.35) NCEH1POLBKCNH2ALDH1A1MEN1
SCHEMBL6513683 0.79 HPGD (0.42) NCEH1POLBKCNH2ALDH1A1MEN1
SCHEMBL6513679 0.79 HPGD (0.42) NCEH1POLBKCNH2ALDH1A1MEN1
SCHEMBL27405101 0.78 GPR35 (0.50) POLBALDH1A1MEN1KMT2ATDP1
SCHEMBL6513674 0.76 ALDH1A1 (0.46) POLBKCNH2ALDH1A1MEN1KMT2A
SCHEMBL28918790 0.75 NCEH1 (0.32) NCEH1MEN1KMT2AGAAL3MBTL1
SCHEMBL48361 0.74 GPR35 (0.53) POLBALDH1A1MEN1KMT2ARAB9A
SCHEMBL48360 0.74 GPR35 (0.53) POLBALDH1A1MEN1KMT2ARAB9A
SCHEMBL27502920 0.74 GPR35 (0.49) POLBALDH1A1MEN1KMT2ATDP1
SCHEMBL16519973 0.73 TDP1 (0.48) ALDH1A1MEN1KMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0969083-B1 DNA CAPILLARY OLYMPUS OPTICAL CO (JP) 2004-03-24 EP disclosed
US-20030148367-A1 Comprises fluid passageway having immobilized oligonucleotide probes for detection of target DNA or messenger RNA OLYMPUS OPTICAL CO., LTD., A JAPANESE CORPORATION (JP) 2003-08-07 US disclosed
US-6559296-B2 Cylindrical fluid flow passageways OLYMPUS OPTICAL CO., LTD. (JP) 2003-05-06 US disclosed
US-20020013457-A1 DNA capillary OLYMPUS OPTICAL CO., LTD. (JP) 2002-01-31 US disclosed
EP-0969083-A1 DNA CAPILLARY OLYMPUS OPTICAL CO., LTD. (JP) 2000-01-05 EP disclosed