SCHEMBL6038369

SCHEMBL6038369

COc1ccc(OC)c(S(=O)(=O)Nc2ncc(Br)nc2OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 7/20 0.53
EDNRA P25101 4/20 0.53
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 2/20 0.51
ALPL P05186 2/20 0.51
TNF P01375 1/20 0.49
NOD2 Q9HC29 1/20 0.49
NOD1 Q9Y239 1/20 0.49
MEN1 O00255 1/20 0.48
ALOX12 P18054 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL6038657 0.91 CCR4 (0.54) CCR4EDNRAALPLKMT2A
SCHEMBL6038631 0.90 CCR4 (0.58) CCR4EDNRAALDH1A1SMN1; SMN2ALPL
SCHEMBL6039138 0.90 CCR4 (0.63) CCR4EDNRAALPL
SCHEMBL6038965 0.85 CCR4 (0.68) CCR4EDNRAALDH1A1
SCHEMBL6039091 0.85 CCR4 (0.56) CCR4EDNRAALPL
SCHEMBL6038944 0.84 SLC40A1 (0.50) CCR4EDNRA
SCHEMBL6039258 0.84 CCR4 (0.62) CCR4EDNRAMEN1KMT2A
SCHEMBL6039125 0.84 CCR4 (0.64) CCR4EDNRAALPL
SCHEMBL6039215 0.82 CCR4 (0.61) CCR4EDNRAALDH1A1SMN1; SMN2LMNA
SCHEMBL6038848 0.81 EDNRA (0.57) CCR4EDNRA

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 1/4885EDNRA 512/4885ALDH1A1 2902/4885

“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.