SCHEMBL10243252

SCHEMBL10243252

CCn1cc(C(=O)O)c(=O)c2cccc(OCCCCNCc3cccc(CC(=O)OC)c3)c21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.42
TLR7 Q9NYK1 1/20 0.40
PDE10A Q9Y233 3/20 0.39
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.36
SLC7A5 Q01650 1/20 0.36
HIF1A Q16665 1/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL10243075 0.95 CNR2 (0.43) CNR2PDE10AKMT2AKDM4EALDH1A1
SCHEMBL10243264 0.86 CNR2 (0.42) CNR2PDE10AKMT2AKDM4EALDH1A1
SCHEMBL10243347 0.79 HTR6 (0.45) TLR7KMT2AKDM4EMEN1SLC7A5
Hydrochloric Acid SCHEMBL336189 0.76 TDP1 (0.43) CNR2KMT2AKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL336139 0.74 TDP1 (0.44) CNR2KMT2AKDM4EALDH1A1TSHR
Hydrochloric Acid SCHEMBL6692838 0.72 CNR2 (0.43) CNR2KMT2AKDM4EALDH1A1TSHR
SCHEMBL11231674 0.71 TDP1 (0.45) CNR2KMT2AKDM4EALDH1A1TSHR
SCHEMBL12028680 0.66 SLC7A5 (0.55) TLR7KMT2AKDM4EALDH1A1MEN1
SCHEMBL10243056 0.66 DRD4 (0.60) KMT2AKDM4EALDH1A1MAPK1MEN1
SCHEMBL336103 0.66 TDP1 (0.63) CNR2KMT2AKDM4EALDH1A1TSHR

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 CNR2 4830/4885TLR7 496/4885PDE10A 182/4885

“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.