SCHEMBL1825650

SCHEMBL1825650

COC(=O)C(OC)c1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
ALDH1A1 P00352 4/20 0.52
MEN1 O00255 4/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 1/20 0.52
ENPP2 Q13822 4/20 0.48
ENPP1 P22413 4/20 0.48
ENPP3 O14638 3/20 0.48
PPARG P37231 1/20 0.46
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
AKR1C3 P42330 1/20 0.42
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
CA12 O43570 2/20 0.41
CA2 P00918 2/20 0.41
RECQL P46063 1/20 0.40

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
SCHEMBL1825373 0.88 KMT2A (0.49) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1828235 0.88 KMT2A (0.53) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1826116 0.88 TDP1 (0.49) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1826317 0.87 ALDH1A1 (0.48) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1823467 0.86 ALDH1A1 (0.52) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1823160 0.85 KMT2A (0.50) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1825880 0.85 KMT2A (0.50) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1827374 0.85 GPR17 (0.47) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1823629 0.83 P2RX7 (0.49) KMT2AALDH1A1MEN1MAPTHTT
SCHEMBL1823784 0.83 ALDH1A1 (0.48) KMT2AALDH1A1MEN1MAPTHTT

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 KMT2A 1068/4885ALDH1A1 1099/4885MEN1 421/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 KMT2A 1084/4885ALDH1A1 1440/4885MEN1 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.