SCHEMBL7783634

SCHEMBL7783634

COC(=O)Cc1ccccc1COc1cccc(Br)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.43
KDM4E B2RXH2 3/20 0.39
PDCD1 Q15116 3/20 0.39
CD274 Q9NZQ7 3/20 0.39
ALDH1A1 P00352 2/20 0.36
ATM Q13315 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPK8 P45983 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.34

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
SCHEMBL8726610 0.85 CFD (0.44) HTR7KDM4EALDH1A1MAPTTDP1
SCHEMBL7778276 0.84 PDCD1 (0.43) KDM4EPDCD1CD274ALDH1A1ATM
SCHEMBL31287376 0.81 SYK (0.43) KDM4EPDCD1CD274ALDH1A1ATM
SCHEMBL7777172 0.81 SYK (0.43) KDM4EPDCD1CD274ALDH1A1ATM
SCHEMBL31287377 0.81 SYK (0.43) KDM4EPDCD1CD274ALDH1A1ATM
SCHEMBL7784447 0.81 TDP1 (0.44) KDM4EALDH1A1SMN1; SMN2TDP1HPGD
SCHEMBL8892987 0.79 HTR7 (0.50) HTR7KDM4EALDH1A1SMN1; SMN2MAPK8
SCHEMBL7786033 0.77 HIF1A (0.39) HTR7PDCD1CD274ALDH1A1MAPK8
SCHEMBL23291726 0.76 HTR7 (0.55) HTR7KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL31637815 0.76 HTR7 (0.55) HTR7KDM4EALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0840726-B1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE SYNGENTA LTD (GB) 2001-10-10 EP disclosed
US-6020524-A Process for the preparation of 2-(pyrid-2-yloxymethyl)phenylacetates as pesticide intermediates ZENECA LIMITED (GB) 2000-02-01 US disclosed
US-6015905-A REACTING OXY-METAL DERIVATIVE OF A DISUBSTITUTED PYRIDINE WITH METHYL ESTER OF PHENYLACETIC ACID(WHICH ALSO HAS ALKYL SUBSTITUENT ON RING) YIELDS INTERMEDIATE FOR PREPARATION OF AGRICULTURAL FUNGICIDES ZENECA LIMITED 2000-01-18 US disclosed
EP-0854866-B1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LTD (GB) 1999-11-17 EP disclosed
US-5942623-A REACTING A SPECIFIC PYRIDINE HAVING A LEAVING GROUP IN THE 2 POSITION WITH A DI-ALKALI METAL SALT OF 2-HYDROXYMETHYLPHENYLACETIC ACID; USED TO MAKE METHYL 2-(2-(PYRID-2-YLOXYMETHYL)PHENYL)-3-METHOXYACRYLATE PESTICIDES ZENECA LIMITED (GB) 1999-08-24 US disclosed
EP-0854866-A1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LIMITED (GB) 1998-07-29 EP disclosed
CN-1189155-A Process for preparation of 2-(6-substituted pyrid-2-yloxymethyl) phenylacetate ZENECA LTD (GB) 1998-07-29 CN disclosed
EP-0840726-A1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE ZENECA LIMITED (GB) 1998-05-13 EP disclosed
WO-1997012864-A1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LIMITED (GB) 1997-04-10 WO disclosed
WO-1997001538-A1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE ZENECA LIMITED (GB) 1997-01-16 WO disclosed