SCHEMBL3173618

SCHEMBL3173618

CCC(c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 5/20 0.55
▸ LTA4H P09960 1/20 0.55
▸ CALM1 P0DP23 1/20 0.52
▸ ESR1 P03372 3/20 0.50
▸ APP P05067 2/20 0.50
▸ GAA P10253 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ KIF11 P52732 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ NR1I2 O75469 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ S100B P04271 1/20 0.42

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
SCHEMBL8212107 0.92 ESR2 (0.47) ESR2LTA4HCALM1ESR1APP
SCHEMBL13070216 0.92 LMNA (0.50) ESR2LTA4HCALM1ESR1APP
SCHEMBL505601 0.85 ESR1 (0.65) ESR2ESR1NR1I2CA12CA1
SCHEMBL8212109 0.85 MAPT (0.47) ESR2LTA4HGAAKIF11KCNH2
SCHEMBL8760915 0.85 ESR1 (0.73) ESR2LTA4HCALM1ESR1APP
SCHEMBL8760898 0.83 ESR2 (0.53) ESR2LTA4HCALM1ESR1APP
SCHEMBL3185263 0.83 KIF11 (0.58) ESR2LTA4HCALM1ESR1APP
SCHEMBL13060384 0.82 KIF11 (0.62) LTA4HKIF11KCNH2CA12CA1
SCHEMBL462675 0.82 KIF11 (0.62) LTA4HKIF11KCNH2CA12CA1
SCHEMBL12004549 0.79 ESR1 (0.58) ESR2ESR1KIF11

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-7648811-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2010-01-19 — — US disclosed
US-7396895-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2008-07-08 — — US disclosed
US-20080118853-A1 BRANCHED POLYARYLENE ETHERS AND PROCESSES FOR THE PREPARATION THEREOF XEROX CORPORATION (US) 2008-05-22 — — US disclosed
US-7067608-B2 Process for preparing branched polyarylene ethers XEROX CORPORATION (US) 2006-06-27 — — US disclosed
US-20050208416-A1 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION 2005-09-22 — — US disclosed
US-20050154178-A1 Process for preparing branched polyarylene ethers XEROX CORPORATION 2005-07-14 — — US disclosed
Send feedback