SCHEMBL7047832

SCHEMBL7047832

Cc1cccc([N+](=O)[O-])c1OC(=O)C1c2ccccc2N(CC(=O)OS(=O)(=O)C(F)(F)F)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 6/20 0.35
LMNA P02545 3/20 0.35
ALDH1A1 P00352 6/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.32
KDM4E B2RXH2 3/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
GSK3B P49841 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CES2 O00748 1/20 0.31
ACHE P22303 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL7050778 0.87 PPARG (0.33) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7047676 0.86 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7047551 0.82 PPARG (0.37) MEN1KMT2AMAPTALDH1A1TDP1
SCHEMBL7049410 0.81 MEN1 (0.34) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7046746 0.81 MEN1 (0.34) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7043949 0.81 ALDH1A1 (0.35) MEN1KMT2AALDH1A1HPGD
SCHEMBL7046990 0.81 KMT2A (0.33) MEN1KMT2AALDH1A1L3MBTL1HPGD
SCHEMBL7047503 0.81 MEN1 (0.31) MEN1KMT2AALDH1A1HPGD
SCHEMBL7049435 0.80 ALDH1A1 (0.35) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7044723 0.80 CYP1A2 (0.36) MEN1KMT2AMAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0609885-B1 Acridinium compounds and conjugates thereof MOCHIDA PHARM CO LTD (JP) 2003-04-16 EP disclosed
US-5594112-A CHEMILUMINESCENCE LABEL MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
US-5438139-A Chemiluminescent; useful as immunolochemical, DNA probe and receptor bininding assays MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-08-01 US disclosed
EP-0609885-A1 Acridinium compounds and conjugates thereof MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1994-08-10 EP disclosed