SCHEMBL6038467

SCHEMBL6038467

COc1ccc(COc2nc(-c3cccc(C=O)c3)cnc2NS(=O)(=O)c2ccc(C)cc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.56
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
PAX8 Q06710 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
EDNRA P25101 7/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MAPT P10636 3/20 0.38
KMO O15229 1/20 0.38
TSHR P16473 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
SCHEMBL6038953 0.89 CCR4 (0.59) CCR4ALDH1A1MEN1KMT2AMAOA
SCHEMBL6038560 0.89 CCR4 (0.58) CCR4ALDH1A1NPC1RAB9APAX8
SCHEMBL6038535 0.88 CCR4 (0.65) CCR4NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL6038583 0.87 CCR4 (0.60) CCR4ALDH1A1NPC1RAB9APAX8
SCHEMBL6038707 0.85 CCR4 (0.47) CCR4ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6038637 0.83 CCR4 (0.68) CCR4SMN1; SMN2MEN1KMT2AEDNRA
SCHEMBL6039115 0.81 CCR4 (0.53) CCR4
SCHEMBL6038499 0.80 CCR4 (0.82) CCR4EDNRA
SCHEMBL6038792 0.76 CCR4 (0.47) CCR4ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6038976 0.75 CCR4 (0.50) CCR4ALDH1A1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004010-A1 Ccr4 antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 US disclosed
EP-1541563-A1 CCR4 ANTAGONIST AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-06-15 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 (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-20060004010-A1 Ccr4 antagonist and medical use thereof CCR4, CCR1, CCR9 CCR4 1/4885ALDH1A1 2902/4885NPC1 1760/4885

“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.