SCHEMBL5523919

SCHEMBL5523919

CCOC(=O)CC(=O)c1cc(F)c(F)c(OC(F)(F)Cl)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MIF P14174 1/20 0.36
POLB P06746 1/20 0.34
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NLRP3 Q96P20 1/20 0.33
CASP1 P29466 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP7 P55210 1/20 0.32
HTT P42858 1/20 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
SCHEMBL966496 0.83 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL30181119 0.83 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL3197468 0.82 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL30958584 0.80 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL1185918 0.80 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL7811132 0.80 ALDH1A1 (0.41) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL7005401 0.80 ALDH1A1 (0.41) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL10401130 0.79 KDM4E (0.40) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL3190199 0.79 MEN1 (0.41) ALDH1A1KDM4EMEN1KMT2AMIF
SCHEMBL9266164 0.79 MEN1 (0.41) ALDH1A1KDM4EMEN1KMT2AMIF

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
US-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-13 US disclosed
US-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-13 US disclosed
US-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-13 US disclosed
EP-1732897-A1 QUINOLONE CARBOXYLIC ACID DERIVATIVES FOR TREATMENT OF HYPERPROLIFERATIVE CONDITIONS Bayer Pharmaceuticals Corporation (US) 2006-12-20 EP disclosed
WO-2005097752-A1 QUINOLONE CARBOXYLIC ACID DERIVATIVES FOR TREATMENT OF HYPERPROLIFERATIVE CONDITIONS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213339-A1 Quinolone Carboxylic Acid Derivatives for Treatment of Hyperproliferative Conditions TP53, RB1, HRAS ALDH1A1 272/4885KDM4E 2571/4885MEN1 1653/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.