SCHEMBL1827082

SCHEMBL1827082

CCCC(C)c1ccc(OS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.48
ADAMTS4 O75173 1/20 0.47
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
MAOB P27338 2/20 0.42
CA12 O43570 2/20 0.39
CA2 P00918 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
EGFR P00533 1/20 0.39
ENPP3 O14638 3/20 0.39
ENPP1 P22413 3/20 0.39
ENPP2 Q13822 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
SCHEMBL1825104 0.88 TDP1 (0.54) TDP1SMN1; SMN2ADAMTS4MAPTNPC1
SCHEMBL1828090 0.87 MEN1 (0.51) SMN1; SMN2MAPTALDH1A1CA12CA2
SCHEMBL1825091 0.86 SMN1; SMN2 (0.46) TDP1SMN1; SMN2ADAMTS4ALDH1A1L3MBTL1
SCHEMBL26317205 0.82 TDP1 (0.46) TDP1SMN1; SMN2ADAMTS4MAPTNPC1
SCHEMBL24604537 0.81 ALDH1A1 (0.41) TDP1ALDH1A1L3MBTL1GAACA12
SCHEMBL8501868 0.81 TDP1 (0.57) TDP1SMN1; SMN2ADAMTS4MAPTNPC1
SCHEMBL1826030 0.80 TDP1 (0.56) TDP1SMN1; SMN2ADAMTS4MAPTNPC1
SCHEMBL1826108 0.80 TDP1 (0.59) TDP1SMN1; SMN2ADAMTS4MAPTNPC1
SCHEMBL1823354 0.80 KDM4E (0.40) TDP1SMN1; SMN2ALDH1A1GAA
SCHEMBL1824852 0.78 TDP1 (0.57) TDP1SMN1; SMN2ADAMTS4MAPTNPC1

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 TDP1 4543/4885SMN1; SMN2 2274/4885ADAMTS4 4799/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 TDP1 4702/4885SMN1; SMN2 3216/4885ADAMTS4 4532/4885

“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.