SCHEMBL7229828

SCHEMBL7229828

CCOC(=O)c1cn(-c2ccc(F)cc2F)c2nc3c(F)c(F)c(F)cc3cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
STAT3 P40763 2/20 0.45
KMT2A Q03164 3/20 0.45
EPHA2 P29317 1/20 0.44
FLT4 P35916 1/20 0.44
GSK3B P49841 1/20 0.44
RARB P10826 1/20 0.44
TBXAS1 P24557 1/20 0.44
SLC6A3 Q01959 1/20 0.44
ALDH1A1 P00352 5/20 0.43
TSHR P16473 3/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 3/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
XBP1 P17861 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL7228651 0.87 MAPT (0.46) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL7228219 0.87 CSF1R (0.44) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL5416374 0.86 KMT2A (0.52) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL10549291 0.86 KMT2A (0.49) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL6603176 0.86 EPHA2 (0.57) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL3236130 0.84 KMT2A (0.48) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL10549552 0.83 KMT2A (0.47) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL10414338 0.83 KMT2A (0.48) MAPTTHRBSTAT3KMT2AEPHA2
SCHEMBL8942151 0.83 STAT3 (0.45) MAPTTHRBSTAT3KMT2AALDH1A1
SCHEMBL18313046 0.82 MAPT (0.51) MAPTTHRBSTAT3KMT2AEPHA2

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-6548506-B2 1-substituted,3-carboxy,7-fluoro,8-disubstituted amino-1,4-dihydrobenzo(b)(1,8)naphthyridin-4-ones; Useful as antimicrobial agents; topical antibiotic for wounds AVENTIS PHARMA S.A. (FR) 2003-04-15 US disclosed
US-20020037891-A1 Novel benzo[1,8]naphthyridine derivatives, their preparation and pharmaceutical compositions which comprise them AVENTIS PHARMA S.A. (FR) 2002-03-28 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 (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-20020037891-A1 Novel benzo[1,8]naphthyridine derivatives, their preparation and pharmaceutical compositions which comprise them ABCB11, NDUFA9, NDUFC1 MAPT 2972/4885THRB 4677/4885STAT3 4134/4885

“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.