SCHEMBL1826698

SCHEMBL1826698

Cc1ccc(S(=O)(=O)Oc2cccc(C(CNC(=O)OCC3c4ccccc4-c4ccccc43)C(=O)OC(C)(C)C)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.37
P2RX7 Q99572 2/20 0.37
EPHX2 P34913 1/20 0.36
KMT2A Q03164 2/20 0.36
CASP3 P42574 2/20 0.36
BACE1 P56817 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL1825845 0.94 CASP3 (0.40) BMP1EPHX2KMT2ACASP3BACE1
SCHEMBL1824939 0.92 BMP1 (0.40) BMP1EPHX2KMT2ACASP3ALDH1A1
SCHEMBL1823490 0.91 BMP1 (0.38) BMP1EPHX2KMT2ACASP3
SCHEMBL1825399 0.91 P2RX7 (0.41) BMP1P2RX7KMT2ACASP3BACE1
SCHEMBL1824560 0.90 BMP1 (0.39) BMP1EPHX2KMT2ACASP3
SCHEMBL1824733 0.88 CASP3 (0.41) BMP1EPHX2KMT2ACASP3BACE1
SCHEMBL1823286 0.88 EPHX2 (0.37) BMP1P2RX7EPHX2KMT2ACASP3
SCHEMBL1823537 0.88 P2RX7 (0.39) BMP1P2RX7EPHX2KMT2ACASP3
SCHEMBL1826735 0.86 P2RX7 (0.40) P2RX7KMT2AALDH1A1
SCHEMBL1824360 0.86 CASP3 (0.41) BMP1EPHX2KMT2ACASP3

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 BMP1 911/4885P2RX7 3606/4885EPHX2 793/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 BMP1 300/4885P2RX7 2747/4885EPHX2 671/4885

“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.