SCHEMBL6480416

SCHEMBL6480416

CC(c1ccccc1)N1CCC(C(=O)C(F)F)C1=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
MAPK1 P28482 1/20 0.46
HSD11B1 P28845 3/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
CYP2D6 P10635 2/20 0.39
HTT P42858 1/20 0.37
PTPN1 P18031 1/20 0.37
P2RX7 Q99572 1/20 0.36

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
SCHEMBL6480423 1.00 KMT2A (0.49) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL892699 0.86 KMT2A (0.57) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL3289241 0.83 KMT2A (0.48) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL3289245 0.83 KMT2A (0.48) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL5629867 0.79 KMT2A (0.48) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL5629865 0.79 KMT2A (0.48) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL6480190 0.77 KMT2A (0.47) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL6480191 0.77 KMT2A (0.47) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL14177730 0.74 ALDH1A1 (0.50) KMT2AMAPK1HSD11B1ALDH1A1HPGD
SCHEMBL14177728 0.74 ALDH1A1 (0.50) KMT2AMAPK1HSD11B1ALDH1A1HPGD

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-20050119231-A1 Quinolone antibacterial agents ELLSWORTH EDMUND L (US) 2005-06-02 US disclosed
US-20050107423-A1 Quinolone antibacterial agents ELLSWORTH EDMUND L (US) 2005-05-19 US 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 (2 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-20050119231-A1 Quinolone antibacterial agents NQO2, MRPL21, TOP1 KMT2A 4774/4885MAPK1 3325/4885HSD11B1 2578/4885
US-20050107423-A1 Quinolone antibacterial agents NQO2, MRPL21, TOP1 KMT2A 4774/4885MAPK1 3325/4885HSD11B1 2578/4885

“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.