SCHEMBL14213161

SCHEMBL14213161

CCOCCNCc1cnc(CC)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.38
THRB P10828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.36
S1PR2 O95136 2/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
LPAR2 Q9HBW0 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 2/20 0.34
GCK P35557 1/20 0.34
SCN8A Q9UQD0 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RAD52 P43351 1/20 0.33
PAX8 Q06710 1/20 0.33
CA2 P00918 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
SCHEMBL14213771 0.90 KDM4E (0.39) KDM4ES1PR2S1PR1S1PR3LPAR2
SCHEMBL14213343 0.82 S1PR2 (0.43) KDM4EHTTS1PR2S1PR1S1PR3
SCHEMBL14182589 0.82 SCN2A (0.39) KDM4ETHRBTDP1HTTS1PR2
SCHEMBL14213086 0.80 MAP4K1 (0.34) S1PR2S1PR1S1PR3LPAR2ALDH1A1
SCHEMBL12841912 0.75 KDM4E (0.46) KDM4ETHRBTDP1HTTSMN1; SMN2
SCHEMBL14747737 0.75 KDM4E (0.48) KDM4ETHRBTDP1HTTSMN1; SMN2
SCHEMBL14182595 0.74 KDM4E (0.48) KDM4ETHRBTDP1HTTS1PR2
SCHEMBL14213088 0.74 DPP7 (0.48) MEN1KMT2A
SCHEMBL12842028 0.73 KDM4E (0.37) KDM4EMEN1KMT2ALMNASCN8A
SCHEMBL14182593 0.72 KDM4E (0.38) KDM4ETDP1HTTS1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119451-A1 Novel Benzamide Derivatives ASTRAZENECA AB (SE) 2008-05-22 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-20080119451-A1 Novel Benzamide Derivatives HDAC1, HDAC11, HDAC2 KDM4E 265/4885THRB 1247/4885TDP1 2140/4885

“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.