SCHEMBL6038784

SCHEMBL6038784

Cc1ccc(S(=O)(=O)Nc2nccnc2OCCN(C)Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIMK2 P53671 1/20 0.45
KCNA5 P22460 7/20 0.45
PTGDR2 Q9Y5Y4 2/20 0.45
AR P10275 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
CCR4 P51679 1/20 0.42
CCR2 P41597 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6038822 0.86 KDM4E (0.56) LIMK2KCNA5ARMEN1KMT2A
SCHEMBL6038594 0.85 PTGDR2 (0.48) PTGDR2MEN1KMT2ACCR4CCR2
SCHEMBL6038918 0.85 AR (0.49) ARMEN1KMT2ACCR2ALDH1A1
SCHEMBL6039097 0.84 MEN1 (0.48) KCNA5ARMEN1KMT2ACCR2
SCHEMBL6038757 0.83 AR (0.47) KCNA5ARMEN1KMT2ACCR2
SCHEMBL6039144 0.82 AR (0.60) ARMEN1KMT2ACCR2ALDH1A1
SCHEMBL6038954 0.81 KMT2A (0.50) ARMEN1KMT2ACCR2ALDH1A1
SCHEMBL6038656 0.81 AR (0.51) ARMEN1KMT2ACCR2ALDH1A1
SCHEMBL6038488 0.79 KDM4E (0.64) MEN1KMT2ATMEM97SIGMAR1ALDH1A1
SCHEMBL6039119 0.77 PTGDR2 (0.52) LIMK2PTGDR2MEN1KMT2ACCR2

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 LIMK2 3875/4885KCNA5 3374/4885PTGDR2 985/4885

“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.