SCHEMBL3786165

SCHEMBL3786165

O=S(=O)(Nc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.73
HSP90AA1 P07900 1/20 0.73
HSP90AB1 P08238 1/20 0.73
CCR2 P41597 3/20 0.57
PGR P06401 1/20 0.56
SLC40A1 Q9NP59 1/20 0.55
ALDH1A1 P00352 1/20 0.54
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53

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
SCHEMBL11027219 0.88 ERBB2 (0.71) ERBB2HSP90AA1HSP90AB1CCR2PGR
SCHEMBL5801599 0.88 ERBB2 (0.67) ERBB2HSP90AA1HSP90AB1CCR2PGR
SCHEMBL12838827 0.85 ERBB2 (1.00) ERBB2HSP90AA1HSP90AB1CCR2ALDH1A1
SCHEMBL2766570 0.85 ERBB2 (0.68) ERBB2HSP90AA1HSP90AB1CCR2PGR
SCHEMBL1138730 0.85 ERBB2 (0.68) ERBB2HSP90AA1HSP90AB1CCR2PGR
SCHEMBL10891615 0.85 ALDH1A1 (0.67) ERBB2HSP90AA1HSP90AB1CCR2ALDH1A1
SCHEMBL6802646 0.85 ERBB2 (0.77) ERBB2HSP90AA1HSP90AB1CCR2ALDH1A1
SCHEMBL12032535 0.83 ERBB2 (0.66) ERBB2HSP90AA1HSP90AB1CCR2PGR
SCHEMBL5956021 0.83 APP (0.66) CCR2ALDH1A1LMNAHTT
SCHEMBL9931082 0.83 CCR2 (0.67) CCR2

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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 ERBB2 221/4885HSP90AA1 4759/4885HSP90AB1 4609/4885

“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.