Anethole

Anethole

SCHEMBL2059918

CC=Cc1ccc(OC)cc1.[NaH]

nearest known ligand 0.95

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.95
CYP3A4 P08684 2/20 0.95
LMNA P02545 2/20 0.95
ALDH1A1 P00352 2/20 0.95
TP53 P04637 1/20 0.95
TSHR P16473 1/20 0.95
RELA Q04206 2/20 0.61
TRPA1 O75762 1/20 0.61
CYP1A2 P05177 3/20 0.59
CYP1A1 P04798 3/20 0.59
CYP1B1 Q16678 3/20 0.59
ESR1 P03372 2/20 0.59
PTGS2 P35354 2/20 0.59
TUBB4A P04350 2/20 0.59
TUBB P07437 2/20 0.59
TUBA3C P0DPH7 2/20 0.59
AHR P35869 2/20 0.59
TUBA1B P68363 2/20 0.59
TUBA4A P68366 2/20 0.59
TUBB4B P68371 2/20 0.59

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
Anethole SCHEMBL2059915 1.00 KDM4E (0.95) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL5309553 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL28973055 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL48600 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL2222515 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL57011 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL48599 0.98 KDM4E (1.00) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL29399255 0.95 KDM4E (0.95) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL28879104 0.95 KDM4E (0.95) KDM4ECYP3A4LMNAALDH1A1TP53
Anethole SCHEMBL28663138 0.95 KDM4E (0.95) KDM4ECYP3A4LMNAALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229251-B1 A PROCESS FOR PREPARING NANOPARTICLES PROVOST FELLOWS & SCHOLARS COLLEGE OF THE HOLY UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2013-03-20 EP claimed
US-20110064603-A1 PROCESS FOR PREPARING NANOPARTICLES PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN, THE (IE) 2011-03-17 US claimed
EP-2229251-A2 A PROCESS FOR PREPARING NANOPARTICLES The Provost, Fellows And Scholars Of The College Of The Holy And Undivided Trinity Of Queen Elizabeth (IE) 2010-09-22 EP claimed
WO-2009081386-A2 A PROCESS FOR PREPARING NANOPARTICLES THE PROVOST FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2009-07-02 WO claimed
US-8808420-B2 Process for preparing nanoparticles THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2014-08-19 US disclosed
EP-2229251-B1 A PROCESS FOR PREPARING NANOPARTICLES PROVOST FELLOWS & SCHOLARS COLLEGE OF THE HOLY UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2013-03-20 EP disclosed
US-20110064603-A1 PROCESS FOR PREPARING NANOPARTICLES PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN, THE (IE) 2011-03-17 US disclosed
EP-2229251-A2 A PROCESS FOR PREPARING NANOPARTICLES The Provost, Fellows And Scholars Of The College Of The Holy And Undivided Trinity Of Queen Elizabeth (IE) 2010-09-22 EP disclosed
WO-2009081386-A2 A PROCESS FOR PREPARING NANOPARTICLES THE PROVOST FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2009-07-02 WO disclosed