SCHEMBL11270840

SCHEMBL11270840

O=C(c1ccccc1)N([O-])c1ccccc1.O=C(c1ccccc1)N([O-])c1ccccc1.[Cu+2]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
RAB9A P51151 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ADRA2C P18825 1/20 0.44
KDM4E B2RXH2 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
ALDH1A1 P00352 2/20 0.42
DAO P14920 1/20 0.42
TSHR P16473 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
LMNA P02545 1/20 0.41
HPGD P15428 3/20 0.41
NR3C2 P08235 1/20 0.40
MLYCD O95822 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
SCHEMBL11681600 0.96 L3MBTL1 (0.48) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL11256256 0.96 L3MBTL1 (0.48) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
Acetic Acid SCHEMBL11258107 0.88 RAB9A (0.43) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL11264333 0.79 CRHBP (0.59) L3MBTL1TDP1SMN1; SMN2KMT2ANPSR1
SCHEMBL10937900 0.75 L3MBTL1 (0.53) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL1003807 0.75 NPSR1 (0.61) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL133668 0.73 KDM4E (0.67) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL21409691 0.73 L3MBTL1 (0.52) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL8979288 0.73 L3MBTL1 (0.52) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C
SCHEMBL11270838 0.71 KDM4E (0.65) L3MBTL1RAB9ATDP1SMN1; SMN2ADRA2C

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-4365082-A CATALYTIC OXIDATION, ESTERIFICATION INSTITUT FRANCAIS DU PETROLE (FR) 1982-12-21 US claimed
US-4365082-A CATALYTIC OXIDATION, ESTERIFICATION INSTITUT FRANCAIS DU PETROLE (FR) 1982-12-21 US disclosed