Anethole

Anethole

SCHEMBL4776777

CC=Cc1ccc(OC)cc1.COc1ccccc1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.83
KDM4E B2RXH2 2/20 0.83
LMNA P02545 1/20 0.83
TP53 P04637 1/20 0.83
TSHR P16473 1/20 0.83
ALDH1A1 P00352 1/20 0.83
TRPA1 O75762 1/20 0.73
CA4 P22748 1/20 0.58
RELA Q04206 5/20 0.58
LTA4H P09960 1/20 0.56
BCHE P06276 1/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
NFE2L2 Q16236 3/20 0.53
CYP1A2 P05177 3/20 0.53
ESR1 P03372 2/20 0.53
CYP1A1 P04798 2/20 0.53
CYP1B1 Q16678 2/20 0.53
ABL1 P00519 1/20 0.53
TTR P02766 1/20 0.53

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 SCHEMBL4776769 1.00 CYP3A4 (0.83) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL3487274 0.96 CYP3A4 (0.83) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL3487279 0.96 CYP3A4 (0.83) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL3487277 0.96 CYP3A4 (0.83) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL57011 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL48600 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL5309553 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL48599 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL2222515 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR
Anethole SCHEMBL28973055 0.91 KDM4E (1.00) CYP3A4KDM4ELMNATP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981686-A2 DRY ICE BLASTING WITH CHEMICAL ADDITIVES L'AIR LIQUIDE, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2008-10-22 EP claimed
US-20070261436-A1 DRY ICE PRODUCTS AND METHOD OF MAKING SAME SUNDARAM MEENAKSHI 2007-11-15 US claimed
WO-2007088437-A2 DRY ICE BLASTING WITH CHEMICAL ADDITIVES L'AIR LIQUIDE-SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (US) 2007-08-09 WO claimed
WO-2007088442-A1 DRY ICE PRODUCTS AND METHOD OF MAKING SAME L'AIR LIQUIDE-SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (US) 2007-08-09 WO claimed
US-20070178811-A1 DRY ICE BLASTING WITH CHEMICAL ADDITIVES SUNDARAM MEENAKSHI 2007-08-02 US claimed