SCHEMBL9890691

SCHEMBL9890691

COC(=O)C(O)c1ccccc1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.46
CHRM3 P20309 5/20 0.41
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CNR2 P34972 2/20 0.40
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
PTPRC P08575 1/20 0.38
APP P05067 2/20 0.37
KMT2A Q03164 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CASP1 P29466 1/20 0.36
CTSA P10619 1/20 0.35

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
SCHEMBL9890688 0.89 HSP90AA1 (0.46) CHRM3SLC6A3RORCRORBKMT2A
SCHEMBL1901275 0.83 KMT2A (0.46) KMT2AALDH1A1
SCHEMBL9890697 0.82 PSEN1 (0.44) CHRM3APPCTSA
SCHEMBL9890692 0.82 CHRM3 (0.44) CHRM3APPCTSA
SCHEMBL9890700 0.81 CHRM3 (0.40) CHRM3SLC6A4SLC6A3KMT2AALDH1A1
SCHEMBL9890698 0.80 CASP1 (0.44) SLC6A4KMT2AHSP90AA1HSP90AB1ALDH1A1
SCHEMBL2391614 0.80 APP (0.43) KCNA5CNR2RORCRORBPTPRC
SCHEMBL2393198 0.80 APP (0.43) KCNA5CNR2RORCRORBPTPRC
SCHEMBL2393200 0.80 APP (0.43) KCNA5CNR2RORCRORBPTPRC
SCHEMBL9890701 0.79 CHRM3 (0.44) CHRM3SLC6A4SLC6A3CTSA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-06-07 US disclosed
US-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-06-07 US disclosed
EP-2374790-A1 BIPHENYLACETAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2011-10-12 EP disclosed
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 US disclosed
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 US 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 (2 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-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 KCNA5 41/4885CHRM3 298/4885SLC6A4 932/4885
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 KCNA5 41/4885CHRM3 298/4885SLC6A4 932/4885

“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.