SCHEMBL6131132

SCHEMBL6131132

CCc1cc(Sc2cc(CC)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.61
ALDH1A1 P00352 9/20 0.46
TSHR P16473 4/20 0.46
LMNA P02545 3/20 0.46
GAA P10253 3/20 0.46
MAPK1 P28482 4/20 0.44
CYP3A4 P08684 3/20 0.44
HIF1A Q16665 3/20 0.44
ALOX15 P16050 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 2/20 0.44
BLM P54132 2/20 0.44
ATM Q13315 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
TP53 P04637 2/20 0.44
GMNN O75496 1/20 0.44
GABBR2 O75899 1/20 0.44
CYP2C9 P11712 1/20 0.44
NFKB1 P19838 1/20 0.44

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
SCHEMBL39434 0.84 HSPA5 (0.74) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL8380418 0.82 HSPA5 (0.67) HSPA5ALDH1A1TSHRLMNAGAA
Hydrochloric Acid SCHEMBL6039741 0.80 HSPA5 (0.69) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL8897086 0.79 HSPA5 (0.67) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL30467044 0.77 HSPA5 (0.65) HSPA5ALDH1A1TSHRLMNAGAA
Butylated Hydroxytoluene SCHEMBL4397736 0.77 ALDH1A1 (0.72) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL362006 0.77 HSPA5 (0.65) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL57329 0.77 HSPA5 (0.82) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL27533 0.76 HSPA5 (1.00) HSPA5ALDH1A1TSHRLMNAGAA
SCHEMBL6833615 0.76 HSPA5 (0.62) HSPA5ALDH1A1TSHRLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9834511-B2 Organodiaryl selenoxides and process for preparation thereof EVONIK DEGUSSA GMBH (DE) 2017-12-05 US disclosed
EP-3178829-A1 ORGANODIARYL SELENIUM OXIDES AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 EP disclosed
US-20170158726-A1 ORGANODIARYL SELENOXIDES AND PROCESS FOR PREPARATION THEREOF EVONIK DEGUSSA GMBH (DE) 2017-06-08 US disclosed
WO-2017088987-A1 PROTECTED SELENODIPHENOLS AND METHODS FOR THE PRODUCTION THEREOF EVONIK DEGUSSA GMBH (DE) 2017-06-01 WO disclosed
US-7195865-B2 Method and apparatus for preparing grains of silver salt of organic and method for producing thermally processed image recording material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-27 US disclosed
US-7195865-B2 Method and apparatus for preparing grains of silver salt of organic and method for producing thermally processed image recording material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-27 US disclosed
US-20050253119-A1 Colorant-containing curable composition, color filter using the composition, and method for manufacturing the same FUJI PHOTO FILM CO., LTD. 2005-11-17 US disclosed
EP-0270711-B1 IMPROVED METHOD FOR ROSIN ESTERIFICATION WESTVACO CORPORATION (US) 1992-04-22 EP disclosed
US-4985393-A Bis/hydroxyphenylthio/ Compounds KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1991-01-15 US disclosed
EP-0373561-A2 Heat sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-06-20 EP disclosed
US-3991139-A NORBORNENE DERIVATIVES, PHENOLS, ESTER THIOETHERS SHOWA DENKO KABUSHIKI KAISHA (JA) 1976-11-09 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 (1 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-20170158726-A1 ORGANODIARYL SELENOXIDES AND PROCESS FOR PREPARATION THEREOF SCLY, SELENOI, GPX4 HSPA5 2364/4885ALDH1A1 2085/4885TSHR 1330/4885

“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.