SCHEMBL6038865

SCHEMBL6038865

O=S(=O)(Nc1ncc(Br)nc1OCc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 11/20 0.57
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
EDNRA P25101 2/20 0.47
AR P10275 1/20 0.46
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PKM P14618 1/20 0.44
PGR P06401 1/20 0.44
IDO1 P14902 1/20 0.43

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
SCHEMBL6039064 0.89 CCR4 (0.53) CCR4EDNRAAR
SCHEMBL6038742 0.89 CCR4 (0.71) CCR4EDNRAAR
SCHEMBL6039161 0.88 CCR4 (0.63) CCR4MEN1KMT2AEDNRAAR
SCHEMBL6038858 0.87 CCR4 (0.70) CCR4EDNRA
SCHEMBL6038764 0.87 CCR4 (0.55) CCR4EDNRAAR
SCHEMBL6038758 0.87 CCR4 (0.60) CCR4EDNRAARPGR
SCHEMBL6038358 0.87 CCR4 (0.60) CCR4EDNRAARALDH1A1HPGD
SCHEMBL6039082 0.86 CCR4 (0.58) CCR4EDNRA
SCHEMBL6038965 0.86 CCR4 (0.68) CCR4EDNRAARALDH1A1
SCHEMBL6038713 0.86 CCR4 (0.61) CCR4MEN1KMT2AEDNRAAR

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 1/4885MEN1 2431/4885KMT2A 4190/4885

“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.