SCHEMBL1824830

SCHEMBL1824830

Cc1ccc(S(=O)(=O)Oc2ccc(C(CC(=O)OC(C)C)C(N)C(=O)OCc3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.46
LMNA P02545 3/20 0.42
MAPT P10636 2/20 0.40
ENPP2 Q13822 1/20 0.40
ENPP1 P22413 1/20 0.39
ALDH1A1 P00352 2/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PPARG P37231 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
SCHEMBL3574287 0.94 P2RX7 (0.40) P2RX7ENPP2ENPP1ALDH1A1SMN1; SMN2
SCHEMBL1826448 0.93 P2RX7 (0.49) P2RX7LMNAMAPTENPP2ALDH1A1
SCHEMBL1826182 0.91 P2RX7 (0.48) P2RX7LMNAMAPTENPP2ENPP1
SCHEMBL1828893 0.91 P2RX7 (0.47) P2RX7LMNAMAPTENPP2ENPP1
SCHEMBL1823394 0.90 LMNA (0.40) P2RX7LMNAMAPTPSEN1PSEN2
SCHEMBL1821114 0.88 P2RX7 (0.50) P2RX7LMNAMAPTALDH1A1
SCHEMBL1824923 0.87 P2RX7 (0.43) P2RX7LMNAMAPTENPP2ENPP1
SCHEMBL1824705 0.87 CA1 (0.41) MAPTPPARG
SCHEMBL1823556 0.86 P2RX7 (0.44) P2RX7LMNAMAPTENPP2ENPP1
SCHEMBL1823469 0.86 P2RX7 (0.47) P2RX7LMNAMAPTENPP2ENPP1

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 3606/4885LMNA 1802/4885MAPT 4712/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 P2RX7 2747/4885LMNA 1130/4885MAPT 2237/4885

“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.