SCHEMBL10246762

SCHEMBL10246762

CC(C)(C)NCCCOc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.63
DRD4 P21917 9/20 0.60
DRD2 P14416 8/20 0.60
DRD3 P35462 6/20 0.60
HTR1D P28221 1/20 0.60
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
POLB P06746 1/20 0.58
KCNA3 P22001 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
RECQL P46063 1/20 0.51
CYP2D6 P10635 1/20 0.51
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50

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
SCHEMBL7751165 0.94 KDM4E (0.66) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL14176538 0.87 KDM4E (0.56) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL14176537 0.82 GAA (0.50) HTR1BDRD4DRD2KDM4EALDH1A1
SCHEMBL23664610 0.81 KDM4E (0.60) DRD4DRD2DRD3KDM4EALDH1A1
SCHEMBL8066260 0.81 DRD4 (0.60) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL9029311 0.79 KCNA3 (0.53) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL22144524 0.78 DRD4 (0.74) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL8366754 0.78 HTR1B (0.56) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL8099108 0.78 HTR1B (0.56) HTR1BDRD4DRD2DRD3HTR1D
SCHEMBL1109801 0.78 HTR1B (1.00) HTR1BDRD4DRD2DRD3HTR1D

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 HTR1B 1660/4885DRD4 910/4885DRD2 1514/4885

“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.