SCHEMBL12147253

SCHEMBL12147253

COCCNS(=O)(=O)c1ccc(C)c(-c2cc(Cl)ccc2OCC(=O)OC(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.58
TSHR P16473 3/20 0.58
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
PTGDR2 Q9Y5Y4 8/20 0.57
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PKM P14618 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALOX15 P16050 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
SCHEMBL12147383 0.91 PTGDR2 (0.47) HTTTSHRGAASMN1; SMN2PTGDR2
SCHEMBL12147382 0.90 PTGDR2 (0.46) HTTTSHRGAASMN1; SMN2PTGDR2
SCHEMBL12147389 0.88 PTGDR2 (0.72) HTTTSHRGAASMN1; SMN2PTGDR2
SCHEMBL12147262 0.87 PTGDR2 (0.53) HTTPTGDR2KMT2A
SCHEMBL13261435 0.86 PTGDR2 (0.57) HTTPTGDR2ALDH1A1KDM4E
SCHEMBL13261375 0.84 PTGDR2 (0.55) HTTSMN1; SMN2PTGDR2MEN1KMT2A
SCHEMBL12147472 0.84 PTGDR2 (0.54) PTGDR2
SCHEMBL12147467 0.84 PTGDR2 (0.57) PTGDR2
SCHEMBL12147380 0.83 PTGDR2 (0.58) HTTTSHRGAASMN1; SMN2PTGDR2
SCHEMBL13261446 0.83 PTGDR2 (0.49) PTGDR2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273769-B2 Phenoxy acetic acid derivatives MERCK SERONO SA (CH) 2012-09-25 US disclosed
US-20110288066-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2011-11-24 US disclosed
WO-2010092043-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2010-08-19 WO 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-20110288066-A1 PHENOXY ACETIC ACID DERIVATIVES HRH2, HRH1, HRH3 HTT 4078/4885TSHR 3579/4885GAA 722/4885

“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.