SCHEMBL820641

SCHEMBL820641

NC(=O)C(Sc1ccccc1)Sc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP2C9 P11712 1/20 0.45
EPHX1 P07099 3/20 0.45
LMNA P02545 2/20 0.43
SIRT1 Q96EB6 1/20 0.42
CYP3A4 P08684 2/20 0.41
POLB P06746 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 2/20 0.41
PARP1 P09874 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FFAR1 O14842 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL6686346 0.82 EPHX1 (0.45) CYP2C19HSD17B10EPHX1LMNASIRT1
SCHEMBL5902536 0.78 EPHX1 (0.42) CYP2C19HSD17B10EPHX1LMNASIRT1
SCHEMBL2311192 0.78 EPHX1 (0.66) HSD17B10EPHX1LMNAL3MBTL1TDP1
SCHEMBL6796251 0.77 EPHX1 (0.71) EPHX1LMNAPOLBL3MBTL1MAPT
SCHEMBL11495800 0.76 CYP2C9 (0.44) CYP2C19HSD17B10CYP2C9LMNAPOLB
SCHEMBL3959622 0.74 HTT (0.53) EPHX1LMNAPOLBL3MBTL1SMN1; SMN2
SCHEMBL4595950 0.74 EPHX1 (0.43) CYP2C19HSD17B10EPHX1LMNASIRT1
SCHEMBL15768221 0.73 LMNA (0.43) CYP2C19HSD17B10CYP2C9EPHX1LMNA
SCHEMBL15781198 0.73 LMNA (0.43) CYP2C19HSD17B10CYP2C9EPHX1LMNA
SCHEMBL11021419 0.72 MAOA (0.47) CYP2C19EPHX1CYP3A4FFAR1CYP1A2

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004744-B1 COMPOSITION INCLUDING MULTIPLE FUNCTIONALIZED POLYMERS BRIDGESTONE CORP (JP) 2017-12-06 EP disclosed
EP-2277948-B1 Polyhedral-modified polymer BRIDGESTONE CORP (JP) 2015-02-18 EP disclosed
EP-1805223-B1 FUNCTIONALIZED POLYMER WITH LINKING GROUP BRIDGESTONE CORP (JP) 2014-12-24 EP disclosed
US-8623955-B2 Polyhedral-modified polymer BRIDGESTONE CORPORATION (JP) 2014-01-07 US disclosed
EP-1885775-B1 ENHANCING INTERACTIVITY BETWEEN AMINE-FUNCTIONALIZED POLYMERS AND PARTICULATE FILLERS BRIDGESTONE CORP (JP) 2013-07-24 EP disclosed
US-20130041096-A1 POLYHEDRAL-MODIFIED POLYMER BRIDGESTONE CORPORATION (JP) 2013-02-14 US disclosed
US-8236888-B2 Polyhedral-modified polymer BRIDGESTONE CORPORATION (JP) 2012-08-07 US disclosed
US-20120010355-A1 POLYHEDRAL-MODIFIED POLYMER BRIDGESTONE CORPORATION (JP) 2012-01-12 US disclosed
US-8063153-B2 Functionalized polymer with linking group BRIDGESTONE CORPORATION (JP) 2011-11-22 US disclosed
US-7999029-B2 Polyhedral-modified polymer BRIDGESTONE CORPORATION (JP) 2011-08-16 US disclosed
US-20070149744-A1 Functionalized polymer with linking group BRIDGESTONE CORPORATION (JP) 2007-06-28 US disclosed
US-20070037956-A1 enhanced interactivity with carbon black filler; tire treads; nitroso nitrogen atom reacts at living polymer anion end to give hydroxyamine or oxyamine group bonded to the elastomer chain; quenched with alcohol or acid at N-O oxygen; butadiene-styrene copolymer functionalized with nitrosobenzene BRIDGESTONE CORP. (JP) 2007-02-15 US disclosed
WO-2006128158-A1 ENHANCING INTERACTIVITY BETWEEN AMINE-FUNCTIONALIZED POLYMERS AND PARTICULATE FILLERS BRIDGESTONE CORPORATION (JP) 2006-11-30 WO disclosed
WO-2006050486-A1 POLYHEDRAL-MODIFIED POLYMER BRIDGESTONE CORPORATION (JP) 2006-05-11 WO disclosed
WO-2006047328-A1 FUNCTIONALIZED POLYMER WITH LINKING GROUP BRIDGESTONE CORPORATION (JP) 2006-05-04 WO disclosed
EP-0519188-B1 Process for producing vulcanised carbon black-filled plastics and rubber compositions DEGUSSA (DE) 1997-03-26 EP disclosed
US-5401789-A Reacting an organosilicon compound with the carbon black DEGUSSA AKTIENGESELLSCHAFT (DE) 1995-03-28 US disclosed
EP-0519188-A1 Process for producing vulcanised carbon black-filled plastics and rubber compositions Degussa Aktiengesellschaft (DE) 1992-12-23 EP disclosed
US-5159009-A CARBON BLACKS MODIFIED WITH ORGANOSILICON COMPOUNDS, METHOD OF THEIR PRODUCTION AND THEIR USE IN RUBBER MIXTURES DEGUSSA (DE) 1992-10-27 US disclosed
EP-0468140-A2 With organosilicium-compound chemically modified carbon blacks, method for their preparation and their use Degussa Aktiengesellschaft (DE) 1992-01-29 EP disclosed