SCHEMBL7784447

SCHEMBL7784447

COC(=O)Cc1ccccc1COc1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
TSHR P16473 1/20 0.43
RAB9A P51151 2/20 0.42
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
APOBEC3G Q9HC16 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.39
GRM5 P41594 1/20 0.38
CYP4A11 Q02928 1/20 0.38
GABRA5 P31644 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
SCHEMBL8186213 0.83 CYP4A11 (0.51) TDP1TSHRNPC1ALDH1A1KDM4E
SCHEMBL8486800 0.82 NPC1 (0.41) TDP1TSHRRAB9ALMNASMN1; SMN2
SCHEMBL7778276 0.81 PDCD1 (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL7783634 0.81 HTR7 (0.43) TDP1SMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL1554320 0.79 KDM4E (0.53) TDP1TSHRLMNASMN1; SMN2ALDH1A1
SCHEMBL7583697 0.78 TSHR (0.56) TSHRRAB9ALMNAPKMSMN1; SMN2
SCHEMBL31287376 0.78 SYK (0.43) TDP1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7777172 0.78 SYK (0.43) TDP1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL31287377 0.78 SYK (0.43) TDP1LMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7976970 0.78 ALDH1A1 (0.50) TDP1RAB9ALMNAPKMSMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854866-B1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LTD (GB) 1999-11-17 EP claimed
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 claimed
EP-0854866-A1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LIMITED (GB) 1998-07-29 EP claimed
WO-1997012864-A1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LIMITED (GB) 1997-04-10 WO claimed
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
WO-1997012864-A1 PROCESS FOR THE PREPARATION OF 2-(PYRID-2-YLOXYMETHYL)PHENYLACETATES AS PESTICIDE INTERMEDIATES ZENECA LIMITED (GB) 1997-04-10 WO disclosed