SCHEMBL170122

SCHEMBL170122

O=C1c2ccccc2-c2ccccc2C1(c1ccc(O)c(Br)c1)c1ccc(O)c(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.51
ESR2 Q92731 2/20 0.51
DHFR P00374 5/20 0.49
TYMS P04818 2/20 0.49
S100A4 P26447 1/20 0.44
AKR1C1 Q04828 1/20 0.43
HSP90AA1 P07900 1/20 0.41
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
XBP1 P17861 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.37

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
SCHEMBL2832176 0.88 ESR1 (0.65) ESR1ESR2DHFRTYMSAKR1C1
SCHEMBL29850929 0.88 ESR1 (0.65) ESR1ESR2DHFRTYMSAKR1C1
SCHEMBL21946436 0.85 ESR1 (0.54) ESR1ESR2DHFRTYMSAKR1C1
SCHEMBL172169 0.82 ESR1 (0.77) ESR1ESR2TYMSS100A4MEN1
SCHEMBL172119 0.82 ESR2 (0.51) ESR1ESR2DHFRTYMSS100A4
SCHEMBL172120 0.82 ESR1 (0.51) ESR1ESR2DHFRTYMSS100A4
SCHEMBL13080606 0.80 ESR1 (0.73) ESR1ESR2S100A4MEN1KMT2A
SCHEMBL13080601 0.80 ESR1 (0.52) ESR1ESR2S100A4HSP90AA1MEN1
SCHEMBL171820 0.78 ESR1 (0.51) ESR1ESR2TYMSS100A4HSP90AA1
SCHEMBL3879785 0.75 ESR1 (0.50) ESR1ESR2DHFRTYMSAKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283433-B2 Polycarbonate resin and electrophotographic photosensitive body using the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-10-09 US disclosed
US-8283433-B2 Polycarbonate resin and electrophotographic photosensitive body using the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-10-09 US disclosed
EP-2048180-B1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL CO (JP) 2012-03-07 EP disclosed
US-20100047703-A1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-02-25 US disclosed
US-20100047703-A1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-02-25 US disclosed
EP-2048180-A1 POLYCARBONATE RESIN AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-04-15 EP disclosed