SCHEMBL7777172

SCHEMBL7777172

COC(=O)Cc1ccccc1COc1cccc(C(F)(F)F)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.43
P2RX7 Q99572 1/20 0.40
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
CYP1A2 P05177 1/20 0.38
HPGD P15428 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MITF O75030 1/20 0.36
S1PR4 O95977 1/20 0.36
LMNA P02545 1/20 0.36
S1PR1 P21453 1/20 0.36
STAT3 P40763 1/20 0.36
STAT1 P42224 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAOB P27338 2/20 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
SCHEMBL31287376 1.00 SYK (0.43) SYKP2RX7PDCD1CD274CYP1A2
SCHEMBL31287377 1.00 SYK (0.43) SYKP2RX7PDCD1CD274CYP1A2
SCHEMBL31287374 0.86 CFD (0.42) SYKP2RX7TDP1MAOBTAS2R14
SCHEMBL28334166 0.84 HPGD (0.40) SYKCYP1A2HPGDALDH1A1MAPT
SCHEMBL28738711 0.82 PPARG (0.35) SYKP2RX7MAOBTAS2R14MAOA
SCHEMBL7778276 0.81 PDCD1 (0.43) PDCD1CD274HPGDALDH1A1MAPT
SCHEMBL7783634 0.81 HTR7 (0.43) PDCD1CD274HPGDALDH1A1MAPT
SCHEMBL12378122 0.80 P2RX7 (0.36) SYKP2RX7PDCD1CD274CYP1A2
SCHEMBL28264676 0.79 HIF1A (0.41) SYKP2RX7TAS2R14
SCHEMBL5997860 0.79 SYK (0.39) SYKCYP1A2HPGDALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102115458-B Synthetic method of 3-methoxy-2-aryl methyl acrylate compound 大连九信精细化工有限公司 2019-12-13 CN claimed
CN-112707861-A Method for preparing 2- (6-trifluoromethyl pyridine-2-yloxymethyl) methyl phenylacetate 锦州三丰科技有限公司 2021-04-27 CN disclosed
CN-102115458-B Synthetic method of 3-methoxy-2-aryl methyl acrylate compound 大连九信精细化工有限公司 2019-12-13 CN disclosed
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
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