SCHEMBL10243726

SCHEMBL10243726

COC(=O)NCCNC(C)c1ccc(OC)c(CN2CCCCC2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
KDM4E B2RXH2 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 5/20 0.44
PKM P14618 2/20 0.44
TSHR P16473 3/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
CCR5 P51681 1/20 0.41
TACR1 P25103 1/20 0.40
CACNA1B Q00975 1/20 0.40

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
SCHEMBL10243930 0.99 L3MBTL1 (0.50) L3MBTL1KDM4ETDP1MEN1KMT2A
SCHEMBL10244428 0.90 ALDH1A1 (0.46) L3MBTL1KDM4EMEN1KMT2AALDH1A1
SCHEMBL10244421 0.88 CACNA1B (0.52) L3MBTL1MEN1KMT2AALDH1A1PKM
SCHEMBL336028 0.84 KDM4E (0.53) L3MBTL1KDM4ETDP1MEN1KMT2A
SCHEMBL335108 0.82 KDM4E (0.51) L3MBTL1KDM4ETDP1MEN1KMT2A
SCHEMBL10244047 0.81 L3MBTL1 (0.47) L3MBTL1KDM4ETDP1MEN1KMT2A
SCHEMBL10243957 0.80 L3MBTL1 (0.46) L3MBTL1KDM4ETDP1MEN1KMT2A
SCHEMBL10243926 0.78 PKM (0.46) ALDH1A1PKMTSHR
SCHEMBL10244323 0.75 SLC22A3 (0.51) TSHR
SCHEMBL10244303 0.74 ALDH1A1 (0.43) L3MBTL1KDM4ETDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 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-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 L3MBTL1 2853/4885KDM4E 128/4885TDP1 2672/4885

“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.