SCHEMBL1822845

SCHEMBL1822845

Cc1ccc(S(=O)(=O)Oc2cccc(C(C(=O)OCc3ccccc3)C(N)Cc3ccccc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.46
LMNA P02545 1/20 0.43
LTA4H P09960 1/20 0.42
LAP3 P28838 1/20 0.42
MAPT P10636 1/20 0.41
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
MEN1 O00255 1/20 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

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
SCHEMBL1821828 0.93 P2RX7 (0.41) P2RX7MAPTKMT2APOLBPLAU
SCHEMBL1825135 0.93 LTA4H (0.46) P2RX7LTA4HLAP3KMT2ASMN1; SMN2
SCHEMBL1829278 0.91 PLAU (0.46) P2RX7LTA4HMAPTKMT2APLAU
SCHEMBL1825112 0.90 P2RX7 (0.45) P2RX7LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL1827141 0.90 P2RX7 (0.51) P2RX7LMNALTA4HLAP3MAPT
SCHEMBL1825726 0.89 PLAU (0.42) P2RX7MAPTKMT2APLAUPLAT
SCHEMBL1827267 0.89 P2RX7 (0.46) P2RX7LMNAMAPTKMT2APLAU
SCHEMBL3570917 0.88 SMN1; SMN2 (0.40) KMT2ASMN1; SMN2
SCHEMBL1823534 0.87 P2RX7 (0.43) P2RX7LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL1826709 0.87 P2RX7 (0.44) P2RX7LMNAMAPTKMT2ASMN1; SMN2

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 1802/4885LTA4H 3852/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 P2RX7 2747/4885LMNA 1130/4885LTA4H 3332/4885

“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.