SCHEMBL7049573

SCHEMBL7049573

COc1cccc(F)c1OC(=O)C1c2ccccc2N(CC(=O)OS(=O)(=O)C(F)(F)F)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
NPSR1 Q6W5P4 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
FFAR2 O15552 3/20 0.33
HTT P42858 2/20 0.33
GNRHR P30968 1/20 0.33
GLRA3 O75311 1/20 0.33
GLRB P48167 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HSD11B1 P28845 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 2/20 0.32

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
SCHEMBL7047551 0.83 PPARG (0.37) ALDH1A1MAPTKMT2AMEN1CYP1A2
SCHEMBL7047503 0.83 MEN1 (0.31) ALDH1A1KMT2AMEN1
SCHEMBL7046990 0.83 KMT2A (0.33) ALDH1A1KMT2AMEN1
SCHEMBL7051084 0.81 PKM (0.40) ALDH1A1MAPTKMT2AMEN1CYP1A2
SCHEMBL7048350 0.81 MRGPRX4 (0.33) ALDH1A1MAPTKMT2AMEN1CYP2C9
SCHEMBL7047676 0.81 MEN1 (0.38) ALDH1A1MAPTKMT2AMEN1
SCHEMBL7049677 0.80 FFAR2 (0.30) FFAR2
SCHEMBL7044723 0.80 CYP1A2 (0.36) ALDH1A1MAPTKMT2AMEN1NPSR1
SCHEMBL7046746 0.80 MEN1 (0.34) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL7049410 0.80 MEN1 (0.34) ALDH1A1MAPTKMT2AMEN1RAB9A

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