SCHEMBL1827694

SCHEMBL1827694

CCC(C)c1ccccc1OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
MAPK1 P28482 1/20 0.49
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
GAA P10253 3/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
MAPT P10636 4/20 0.44
ALDH1A1 P00352 4/20 0.44
NPSR1 Q6W5P4 1/20 0.44
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
VDR P11473 1/20 0.42

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
SCHEMBL1825108 0.90 ALDH1A1 (0.47) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL1825870 0.89 LMNA (0.47) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL8526250 0.87 LMNA (0.50) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL28595222 0.85 MEN1 (0.56) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL1827857 0.84 LMNA (0.48) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL1826103 0.82 LMNA (0.55) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL1826319 0.82 LMNA (0.51) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL1823836 0.82 LMNA (0.49) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL2046779 0.82 LMNA (0.38) LMNAMAPK1MEN1KMT2AGAA
SCHEMBL3583111 0.81 LMNA (0.48) LMNAMAPK1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161254-B1 Intermediate for preparing a biaryl compound SUMITOMO CHEMICAL CO (JP) 2014-08-13 EP disclosed
EP-1481967-B1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2011-05-04 EP disclosed
US-7714157-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
EP-2161254-A1 Intermediate for preparing a biaryl compound Sumitomo Chemical Company, Limited (JP) 2010-03-10 EP 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
EP-1481967-A1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS Sumitomo Chemical Company, Limited (JP) 2004-12-01 EP 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 LMNA 1802/4885MAPK1 953/4885MEN1 421/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 LMNA 1130/4885MAPK1 1335/4885MEN1 183/4885

“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.