SCHEMBL5263326

SCHEMBL5263326

COc1cnc2cccc(C(O)CN3CCCC(CNCC4=CC5=CNSN5C=C4)C3)c2c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 8/20 0.36
KCNH2 Q12809 1/20 0.34
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
MCHR1 Q99705 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PRKCQ Q04759 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3688036 0.90 SLC2A1 (0.46) SLC2A1KCNH2KDM4ETSHRMEN1
SCHEMBL3771621 0.86 SLC2A1 (0.47) SLC2A1KCNH2MTNR1AMTNR1B
SCHEMBL5434489 0.85 SLC2A1 (0.35) SLC2A1KCNH2MCHR1
SCHEMBL3781213 0.85 SLC2A1 (0.38) SLC2A1KCNH2KDM4ELMNAGLA
SCHEMBL5262592 0.81 SLC2A1 (0.37) SLC2A1KCNH2MTNR1AMTNR1B
SCHEMBL3690361 0.79 SLC2A1 (0.39) SLC2A1KCNH2MCHR1MEN1KMT2A
SCHEMBL5432414 0.79 KCNH2 (0.45) SLC2A1KCNH2
SCHEMBL5426592 0.78 KCNH2 (0.42) SLC2A1KCNH2MAPTMTNR1AMTNR1B
SCHEMBL5439267 0.78 KCNH2 (0.47) SLC2A1KCNH2
SCHEMBL5266900 0.77 SLC2A1 (0.40) SLC2A1KCNH2KDM4ELMNAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244103-A1 Novel Compounds Having an Anti-Bacterial Activity MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2007-10-18 US disclosed
EP-1781650-A1 NOVEL COMPOUNDS HAVING AN ANTI-BACTERIAL ACTIVITY Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) 2007-05-09 EP disclosed
WO-2006021448-A1 NOVEL COMPOUNDS HAVING AN ANTI-BACTERIAL ACTIVITY Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) 2006-03-02 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-20070244103-A1 Novel Compounds Having an Anti-Bacterial Activity TOP1, TOP2A, TOP2B SLC2A1 4714/4885KCNH2 3363/4885KDM4E 2755/4885

“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.