SCHEMBL3297152

SCHEMBL3297152

CN1CCC(COc2cc(COc3nc4ccccc4nc3NS(=O)(=O)c3ccccc3Cl)ccc2Cl)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CCR4 P51679 3/20 0.40
HRH4 Q9H3N8 2/20 0.40
EGFR P00533 3/20 0.39
KDM4A O75164 1/20 0.39
KDM5A P29375 1/20 0.39
PIK3CG P48736 2/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.37
SRC P12931 1/20 0.37

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
SCHEMBL3298444 0.94 CCR4 (0.47) CCR4HRH4
SCHEMBL3292829 0.94 CCR4 (0.40) MEN1KMT2ACCR4HRH4EGFR
SCHEMBL3294849 0.91 RXFP1 (0.46) PTGDR2MEN1KMT2A
SCHEMBL3293284 0.91 CCR4 (0.45) PTGDR2CCR4EGFR
SCHEMBL3294882 0.91 PTGDR2 (0.42) PTGDR2CCR4EGFRKDM4AKDM5A
SCHEMBL3295353 0.90 ALDH1A1 (0.39) PTGDR2HRH4EGFRKDM4AKDM5A
SCHEMBL3293638 0.90 PTGDR2 (0.42) PTGDR2CCR4EGFRKDM4AKDM5A
SCHEMBL3293357 0.89 MEN1 (0.47) MEN1KMT2ACCR4HRH4EGFR
SCHEMBL3291434 0.87 CCR4 (0.40) CCR4EGFRKDM4AKDM5APIK3CG
SCHEMBL3299632 0.87 CCR4 (0.40) CCR4EGFRKDM4AKDM5APIK3CG

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-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-21 US disclosed
US-7732442-B2 Chemokine receptor antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 US disclosed
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
EP-1661889-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 EP 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 (2 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-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF CCR5, CCR4, CCR1 PTGDR2 681/4885MEN1 3502/4885KMT2A 4641/4885
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof CCR5, CCR4, CCR1 PTGDR2 681/4885MEN1 3502/4885KMT2A 4641/4885

“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.