SCHEMBL1827573

SCHEMBL1827573

Cc1ccc(S(=O)(=O)Oc2ccc(C(N)(CC(=O)OC(C)(C)C)C(=O)OCC3c4ccccc4-c4ccccc43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.38
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
ENPP2 Q13822 4/20 0.34
PPARG P37231 1/20 0.34
ENPP1 P22413 6/20 0.34
ENPP3 O14638 4/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 1/20 0.34
RECQL P46063 1/20 0.34
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL1826076 0.94 CASP3 (0.35) P2RX7ALDH1A1KMT2AMEN1MAPT
SCHEMBL1827497 0.91 ALDH1A1 (0.38) P2RX7ALDH1A1LMNAENPP2PPARG
SCHEMBL1823035 0.91 ALDH1A1 (0.38) P2RX7ALDH1A1LMNAENPP2PPARG
SCHEMBL1822336 0.89 ENPP2 (0.35) P2RX7ALDH1A1LMNAENPP2PPARG
SCHEMBL1824523 0.88 LMNA (0.41) P2RX7ALDH1A1LMNAPPARGENPP1
SCHEMBL1824075 0.88 CA1 (0.36) KMT2ACA1CA2
SCHEMBL1826915 0.86 HSD11B1 (0.38) ALDH1A1LMNAPPARGENPP1ENPP3
SCHEMBL1827178 0.85 CASP3 (0.38) ALDH1A1ENPP2ENPP1ENPP3KMT2A
SCHEMBL1827658 0.83 PPARG (0.42) P2RX7ALDH1A1LMNAENPP2PPARG
SCHEMBL1824713 0.83 P2RX7 (0.51) P2RX7ALDH1A1LMNAPPARGMAPT

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 P2RX7 3606/4885ALDH1A1 1099/4885LMNA 1802/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 P2RX7 2747/4885ALDH1A1 1440/4885LMNA 1130/4885

“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.