SCHEMBL913276

SCHEMBL913276

OCC=CCOC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DUT P33316 3/20 0.50
KIF11 P52732 1/20 0.47
TK1 P04183 5/20 0.47
TK2 O00142 4/20 0.47
KDM4E B2RXH2 1/20 0.37
HRH4 Q9H3N8 1/20 0.34
ALOX15 P16050 2/20 0.33
ALDH1A1 P00352 1/20 0.33
AOC3 Q16853 1/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
PPARG P37231 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A1 P30531 1/20 0.33
CYP1A2 P05177 1/20 0.32

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
SCHEMBL913275 1.00 DUT (0.50) DUTKIF11TK1TK2KDM4E
SCHEMBL12268294 1.00 DUT (0.50) DUTKIF11TK1TK2KDM4E
SCHEMBL5436615 0.83 ALDH1A1 (0.47) DUTKIF11TK1TK2KDM4E
SCHEMBL20974784 0.79 DUT (0.47) DUTKIF11TK1TK2ALDH1A1
SCHEMBL28500553 0.79 DUT (0.47) DUTKIF11TK1TK2ALDH1A1
SCHEMBL8322266 0.79 DUT (0.47) DUTKIF11TK1TK2ALOX15
SCHEMBL8552387 0.79 DUT (0.47) DUTKIF11TK1TK2ALOX15
SCHEMBL6241174 0.76 KIF11 (0.56) DUTKIF11HRH4ALOX15ALDH1A1
SCHEMBL2856185 0.75 KIF11 (0.50) DUTKIF11TK1TK2HRH4
SCHEMBL11303069 0.75 KIF11 (0.50) DUTKIF11TK1TK2HRH4

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017620-B2 Dutpase inhibitors MEDIVIR AB (SE) 2011-09-13 US disclosed
US-20110021459-A1 DUTPASE INHIBITORS MEDIVIR AB (SE) 2011-01-27 US disclosed
US-7795270-B2 DUTPase inhibitors MEDIVIR AB (SE) 2010-09-14 US disclosed
US-20100075924-A1 DUTPASE INHIBITORS MEDIVIR AB (SE) 2010-03-25 US disclosed
US-7601702-B2 Dutpase Inhibitors MEDIVIR AB (SE) 2009-10-13 US disclosed
US-20080312183-A1 Dutpase Inhibitors MEDIVIR AB (SE) 2008-12-18 US disclosed
US-20080300216-A1 Dutpase Inhibitors MEDIVIR AB (SE) 2008-12-04 US disclosed
EP-1701952-A1 DUTPASE INHIBITORS Medivir Aktiebolag (SE) 2006-09-20 EP disclosed
EP-1701727-A1 DUTPASE INHIBITORS Medivir Aktiebolag (SE) 2006-09-20 EP disclosed
WO-2005066160-A1 DUTPASE INHIBITORS MEDIVIR AB (SE) 2005-07-21 WO disclosed
WO-2005065689-A1 DUTPASE INHIBITORS MEDIVIR AB (SE) 2005-07-21 WO disclosed
EP-0282077-B1 Pyridyloxy derivatives FUJIREBIO KK (JP) 1993-11-10 EP disclosed
US-4977267-A ANTISECRETORY AGENT FUJIREBIO KABUSHIKI KAISHA (JP) 1990-12-11 US disclosed
US-4912101-A Containing a secondary amide, suflur group and a furan ring FUJIREBIO KABUSHIKI KAISHA (JP) 1990-03-27 US disclosed
EP-0282077-A2 Pyridyloxy derivatives FUJIREBIO KABUSHIKI KAISHA (JP) 1988-09-14 EP 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 (4 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-20080300216-A1 Dutpase Inhibitors DUT, DHODH, POLR2H DUT 1/4885KIF11 4014/4885TK1 277/4885
US-20080312183-A1 Dutpase Inhibitors DUT, DHODH, RNASEH1 DUT 1/4885KIF11 2729/4885TK1 75/4885
US-20110021459-A1 DUTPASE INHIBITORS DUT, DHODH, NAT10 DUT 1/4885KIF11 2686/4885TK1 118/4885
US-20100075924-A1 DUTPASE INHIBITORS DUT, DHODH, CCNO DUT 1/4885KIF11 3964/4885TK1 292/4885

“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.