SCHEMBL3697147

SCHEMBL3697147

COc1ccc2nccc(C(O)CN3C4CCC3CC(NCC=Cc3ccccc3)C4)c2c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 8/20 0.47
KCNH2 Q12809 5/20 0.47
THRB P10828 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL3697142 1.00 SLC2A1 (0.47) SLC2A1KCNH2THRBKDM4EMEN1
SCHEMBL5317247 0.89 MTNR1A (0.36) SLC2A1KCNH2ALDH1A1
SCHEMBL5317252 0.89 MTNR1A (0.36) SLC2A1KCNH2ALDH1A1
SCHEMBL3688107 0.88 KCNH2 (0.47) SLC2A1KCNH2THRBKDM4EMEN1
SCHEMBL3694553 0.88 KCNH2 (0.47) SLC2A1KCNH2THRBKDM4EMEN1
SCHEMBL5728191 0.87 KCNH2 (0.61) SLC2A1KCNH2
SCHEMBL5430646 0.85 KCNH2 (0.38) SLC2A1KCNH2ALDH1A1
SCHEMBL5430642 0.85 KCNH2 (0.38) SLC2A1KCNH2ALDH1A1
SCHEMBL5432717 0.84 SLC2A1 (0.46) SLC2A1KCNH2
SCHEMBL5432710 0.84 SLC2A1 (0.46) SLC2A1KCNH2

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
EP-2239260-A1 Novel compounds with antibacterial activity Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) 2010-10-13 EP disclosed
US-7223776-B2 Compounds with anti-bacterial activity MORPHOCHEM AG (DE) 2007-05-29 US disclosed
US-20060040949-A1 Novel compounds with antibacterial activity MORPHOCHEM AG 2006-02-23 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-20060040949-A1 Novel compounds with antibacterial activity MRPL21, Q6ZSR9, MRPL19 SLC2A1 4070/4885KCNH2 2411/4885THRB 4006/4885

“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.