SCHEMBL5284554

SCHEMBL5284554

CCOC(=O)c1cc(C2CC2)c2c(C)c(N3CCC(ON)C3)c(F)cn2c1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.37
SCN5A Q14524 1/20 0.37
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
GLA P06280 2/20 0.34
GAA P10253 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL5284548 1.00 KCNH2 (0.37) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL5570849 0.89 KCNH2 (0.36) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL14497297 0.89 KCNH2 (0.36) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL5570851 0.89 KCNH2 (0.36) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL8569539 0.89 SCN5A (0.44) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL8575664 0.89 SCN5A (0.44) KCNH2SCN5AKDM4EALDH1A1HPGD
SCHEMBL8565377 0.89 SCN5A (0.44) KCNH2SCN5AKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL8575905 0.88 SCN5A (0.43) KCNH2SCN5AKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL8569538 0.88 SCN5A (0.43) KCNH2SCN5AKDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL8577938 0.88 SCN5A (0.43) KCNH2SCN5AKDM4EALDH1A1HPGD

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229996-B2 Rifamycin derivatives CUMBRE PHARMACEUTICALS INC. (US) 2007-06-12 US disclosed
EP-1781670-A1 RIFAMYCIN DERIVATIVES FOR TREATING MICROBIAL INFECTIONS Cumbre Pharmaceuticals Inc. (US) 2007-05-09 EP disclosed
WO-2006012470-A1 RIFAMYCIN DERIVATIVES FOR TREATING MICROBIAL INFECTIONS CUMBRE PHARMACEUTICALS INC. (US) 2006-02-02 WO disclosed
US-20060019985-A1 Rifamycin derivatives CUMBRE INC. (US) 2006-01-26 US disclosed
EP-0871628-A1 QUINOLIZINONE TYPE COMPOUNDS Abbott Laboratories (US) 1998-10-21 EP disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 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-20060019985-A1 Rifamycin derivatives RIF1, NQO1, MRM1 KCNH2 2117/4885SCN5A 2077/4885KDM4E 3000/4885

“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.