SCHEMBL10244023

SCHEMBL10244023

COC(=O)NCCNC(C)c1ccc(N2CCN(C)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 8/20 0.46
HDAC8 Q9BY41 8/20 0.46
KMT2A Q03164 1/20 0.43
TP53 P04637 2/20 0.42
LMNA P02545 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
LDHA P00338 1/20 0.42
LDHB P07195 1/20 0.42
CMA1 P23946 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MC4R P32245 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ACACB O00763 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
SCHEMBL10243779 0.86 ACACB (0.44) KMT2ATP53LMNAOPRM1OPRD1
SCHEMBL10243906 0.78 HDAC3 (0.44) HDAC3HDAC8KMT2ATP53LMNA
SCHEMBL335053 0.78 ALDH1A1 (0.47) HDAC3HDAC8KMT2ALMNAOPRM1
SCHEMBL10244285 0.77 ESR1 (0.42) LMNAOPRM1ALDH1A1ACACB
SCHEMBL10243815 0.77 KMT2A (0.41) KMT2AALDH1A1ACACB
SCHEMBL10243724 0.74 KMT2A (0.44) KMT2AALDH1A1GAANPC1RAB9A
SCHEMBL10245497 0.74 ALDH1A1 (0.52) KMT2ATP53ALDH1A1GAARAB9A
SCHEMBL3156564 0.73 NPC1 (0.49) HDAC3HDAC8KMT2ATP53LMNA
SCHEMBL10243828 0.73 GAA (0.48) TP53LMNAGAAACACB
SCHEMBL10243646 0.73 EPHX2 (0.41) KMT2ALMNA

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 HDAC3 78/4885HDAC8 218/4885KMT2A 939/4885

“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.