SCHEMBL5567622

SCHEMBL5567622

COc1c(N2CCC(C(C)NC3CCNCC3)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.74
KDM4E B2RXH2 9/20 0.66
HPGD P15428 4/20 0.66
ALDH1A1 P00352 4/20 0.66
HSD17B10 Q99714 2/20 0.66
POLB P06746 2/20 0.66
TDP1 Q9NUW8 2/20 0.66
PRKD3 O94806 1/20 0.66
ALOX15 P16050 1/20 0.66
OPRM1 P35372 1/20 0.66
CLK2 P49760 1/20 0.66
CLK4 Q9HAZ1 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.60
LMNA P02545 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP2C19 P33261 1/20 0.55
NPSR1 Q6W5P4 1/20 0.53
ATM Q13315 1/20 0.52
TOP1 P11387 1/20 0.49

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
Premafloxacin SCHEMBL8324081 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL30494409 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL1230382 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL30494408 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL6528754 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL7983357 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL8327470 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL8330342 0.88 KCNH2 (0.81) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL1230600 0.88 KCNH2 (0.80) KCNH2KDM4EHPGDALDH1A1HSD17B10
Premafloxacin SCHEMBL1230581 0.88 KCNH2 (0.80) KCNH2KDM4EHPGDALDH1A1HSD17B10

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 7 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
US-7238694-B2 Rifamycin imino derivatives effective against drug-resistant microbes CUMBRE PHARMACEUTICALS, INC. (US) 2007-07-03 US disclosed
EP-1723150-A1 RIFAMYCIN IMINO DERIVATIVES EFFECTIVE AGAINST DRUG-RESISTANT MICROBES Cumbre Pharmaceuticals Inc. (US) 2006-11-22 EP disclosed
US-20050261262-A1 Rifamycin derivatives effective against drug-resistant microbes CUMBRE INC. (US) 2005-11-24 US disclosed
US-20050209210-A1 Rifamycin imino derivatives effective against drug-resistant microbes CUMBRE INC. (US) 2005-09-22 US disclosed
WO-2005070941-A1 RIFAMYCIN IMINO 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 (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-20050261262-A1 Rifamycin derivatives effective against drug-resistant microbes RIF1, MRPL37, AURKAIP1 KCNH2 3101/4885KDM4E 2995/4885HPGD 1984/4885
US-20050209210-A1 Rifamycin imino derivatives effective against drug-resistant microbes RIF1, TOP1, TOP2A KCNH2 3651/4885KDM4E 2157/4885HPGD 1058/4885

“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.