SCHEMBL7050778

SCHEMBL7050778

Cc1cc([N+](=O)[O-])cc(C)c1OC(=O)C1c2ccccc2N(CC(=O)OS(=O)(=O)C(F)(F)F)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPBWR1 P48145 1/20 0.32
ALDH1A1 P00352 2/20 0.31
FKBP1A P62942 1/20 0.31
HPGD P15428 1/20 0.31
TERT O14746 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
P2RY1 P47900 1/20 0.30
PYGL P06737 1/20 0.30
PYGM P11217 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL7046746 0.87 MEN1 (0.34) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7049410 0.87 MEN1 (0.34) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7049435 0.86 ALDH1A1 (0.35) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7049801 0.83 MRGPRX4 (0.34) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL7047676 0.81 MEN1 (0.38) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7044723 0.80 CYP1A2 (0.36) KMT2AMEN1SMN1; SMN2ALDH1A1HPGD
SCHEMBL7048366 0.80 ACLY (0.33)
SCHEMBL7043949 0.80 ALDH1A1 (0.35) KMT2AMEN1ALDH1A1HPGD
SCHEMBL7047503 0.80 MEN1 (0.31) KMT2AMEN1ALDH1A1HPGD
SCHEMBL7049677 0.79 FFAR2 (0.30)

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