SCHEMBL5743401

SCHEMBL5743401

CCOC(=O)C(Br)(Br)CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.42
EGLN1 Q9GZT9 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TRPA1 O75762 1/20 0.38
PKM P14618 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RECQL P46063 1/20 0.37
MMP8 P22894 1/20 0.37
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
THRB P10828 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL27918078 0.77 MEN1 (0.48) PIN1EGLN1POLBNPSR1ALDH1A1
SCHEMBL28246316 0.77 KCNN4 (0.39) EGLN1ALDH1A1KDM4ELMNATSHR
SCHEMBL3097767 0.77 EGLN1 (0.42) PIN1EGLN1POLBNPSR1ALDH1A1
SCHEMBL5963640 0.76 POLB (0.64) PIN1POLBNPSR1ALDH1A1KDM4E
SCHEMBL25975527 0.76 MEN1 (0.42) PIN1NPSR1ALDH1A1TRPA1PKM
SCHEMBL2557186 0.76 ALDH1A1 (0.48) PIN1EGLN1POLBNPSR1ALDH1A1
SCHEMBL1829725 0.76 CYP4F2 (0.50) PIN1EGLN1ALDH1A1PKMKDM4E
SCHEMBL27567116 0.76 EGLN1 (0.41) PIN1EGLN1POLBNPSR1ALDH1A1
SCHEMBL6667303 0.74 HMGCR (0.46) PIN1EGLN1POLBNPSR1ALDH1A1
SCHEMBL7764376 0.74 EGLN1 (0.39) PIN1EGLN1POLBNPSR1ALDH1A1

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-0896972-B1 METHOD FOR PRODUCING A SELENIZED TRANSPARENT OPTICAL MATERIAL MITSUI CHEMICALS INC (JP) 2006-11-29 EP disclosed
US-6664364-B2 Selenium-containing transparent optical material MITSUI CHEMICALS, INC. (JP) 2003-12-16 US disclosed
US-20030166830-A1 Selenium-containing transparent optical material OKAZAKI KOJU (JP) 2003-09-04 US disclosed
US-6482918-B2 HIGH REFRACTIVE INDEX, LOW DISPERSION AND EXCELLENT OPTICAL PROPERTY, AND IS USED FOR A GLASSES LENS, CAMERA LENS, PRISM, SUBSTRATE FOR AN INFORMATION RECORDING MEDIUM, PICK UP LENS, OPTICAL FIBER, OPTICAL FILTER MITSUI CHEMICALS, INC. (JP) 2002-11-19 US disclosed
US-20020120097-A1 Selenium-containing transparent optical material OKAZAKI KOJU (JP) 2002-08-29 US disclosed
US-6303747-B1 SELENIUM-CONTAINING POLYTHIOL HAVING 3 OR MORE FUNCTIONAL GROUPS; MONOMERS FOR PREPARING TRANSPARENT OPTICAL MATERIAL WHICH HAS HIGH REFRACTIVE INDEX, LOW DISPERSION AND EXCELLENT OPTICAL PROPERTIES MITSUI CHEMICALS, INC. (JP) 2001-10-16 US disclosed
US-6124424-A A TRANSPARENT OPTICAL LENS IS OBTAINED BY CAST-POLYMERIZING AT LEAST ONE REACTIVE MONOMER OR OLIGOMER HAVING AT LEAST ONE SELENIUM ATOM IN ITS MOLECULE; IMPROVED REFRACTIVE INDEX MITSUI CHEMICALS, INC. (JP) 2000-09-26 US disclosed
EP-0896972-A1 SELENIZED TRANSPARENT OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 1999-02-17 EP disclosed