SCHEMBL5568331

SCHEMBL5568331

O=C(O)c1cn(-c2ccc(F)cc2F)c2nc(N3CCC(CCCC4CCNCC4)CC3)c(F)cc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.67
EPHA2 P29317 1/20 0.62
FLT4 P35916 1/20 0.62
GSK3B P49841 1/20 0.62
RARB P10826 1/20 0.62
TBXAS1 P24557 1/20 0.62
SLC6A3 Q01959 1/20 0.62
LMNA P02545 6/20 0.57
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 4/20 0.57
HPGD P15428 4/20 0.57
HSD17B10 Q99714 4/20 0.57
HTT P42858 2/20 0.57
POLB P06746 1/20 0.57
XBP1 P17861 1/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
CYP2C9 P11712 2/20 0.53
ATP6V1B2 P21281 1/20 0.53

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
SCHEMBL312827 0.87 KMT2A (0.71) KMT2AEPHA2FLT4GSK3BRARB
Hydrochloric Acid SCHEMBL10551298 0.86 KMT2A (0.70) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL16101790 0.84 KMT2A (0.78) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL5568311 0.83 KMT2A (0.79) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL5572182 0.83 KMT2A (0.73) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL14499425 0.82 KMT2A (0.75) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL5568328 0.82 KMT2A (0.46) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL5571314 0.82 KMT2A (0.71) KMT2AEPHA2FLT4GSK3BRARB
Tosufloxacin SCHEMBL34354 0.81 KMT2A (1.00) KMT2AEPHA2FLT4GSK3BRARB
Tosufloxacin SCHEMBL34355 0.81 KMT2A (1.00) KMT2AEPHA2FLT4GSK3BRARB

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
EP-1730154-B1 RIFAMYCIN DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES CUMBRE IP VENTURES L P (US) 2012-10-17 EP disclosed
US-7247634-B2 Rifamycin derivatives effective against drug-resistant microbes CUMBRE PHARMACEUTICALS INC. (US) 2007-07-24 US disclosed
EP-1730154-A2 RIFAMYCIN DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES Cumbre Pharmaceuticals Inc. (US) 2006-12-13 EP disclosed
US-20050261262-A1 Rifamycin derivatives effective against drug-resistant microbes CUMBRE INC. (US) 2005-11-24 US disclosed
WO-2005070940-A2 RIFAMYCIN DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES CUMBRE PHARMACEUTICALS INC. (US) 2005-08-04 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-20050261262-A1 Rifamycin derivatives effective against drug-resistant microbes RIF1, MRPL37, AURKAIP1 KMT2A 3269/4885EPHA2 4821/4885FLT4 3046/4885

“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.