SCHEMBL3570817

SCHEMBL3570817

COC(=O)C(C)c1cccc(OS(C)(=O)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.54
PTGS2 P35354 2/20 0.54
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
CYP2D6 P10635 1/20 0.43
MT-CO2 P00403 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL1828359 0.87 KMT2A (0.46) PTGS1PTGS2KMT2AALDH1A1POLB
SCHEMBL2834595 0.86 PTGS1 (0.44) PTGS1PTGS2KMT2AMEN1CYP2D6
SCHEMBL1826817 0.85 L3MBTL1 (0.40) PTGS1PTGS2KMT2AALDH1A1
SCHEMBL1824283 0.85 L3MBTL1 (0.40) PTGS1PTGS2KMT2AALDH1A1
SCHEMBL2832592 0.85 PTGS1 (0.65) PTGS1PTGS2KMT2AMEN1CYP2D6
SCHEMBL1825924 0.85 PTGS1 (0.53) PTGS1PTGS2KMT2AMEN1CYP2D6
SCHEMBL1826138 0.85 PTGS1 (0.43) PTGS1PTGS2KMT2AMEN1CYP2D6
SCHEMBL1820336 0.85 PTGS1 (0.53) PTGS1PTGS2KMT2AMEN1CYP2D6
SCHEMBL1826077 0.84 PTGS1 (0.48) PTGS1KMT2AMEN1CYP2D6ALDH1A1
SCHEMBL2839041 0.83 PTGS1 (0.56) PTGS1PTGS2KMT2AMEN1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714157-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
US-20070270603-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2007-11-22 US disclosed
US-7271280-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-18 US disclosed
US-20040158093-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-12 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-20040158093-A1 Process for preparing a biaryl compound CYP1B1, REL, CYP2F1 PTGS1 3787/4885PTGS2 3426/4885KMT2A 1068/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 PTGS1 3968/4885PTGS2 3168/4885KMT2A 1084/4885

“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.