Anisole

Anisole

SCHEMBL4643770

COc1ccccc1.O=Cc1ccccc1

nearest known ligand 0.71

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.71
CYP2A6 P11509 2/20 0.71
CA4 P22748 1/20 0.64
TRPA1 O75762 1/20 0.59
LTA4H P09960 2/20 0.54
TTR P02766 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KMT2A Q03164 3/20 0.49
MAOB P27338 2/20 0.49
MEN1 O00255 2/20 0.49
PPARG P37231 1/20 0.49
NFE2L2 Q16236 1/20 0.49
MAPT P10636 1/20 0.49
HSPD1 P10809 1/20 0.49
TNFRSF1A P19438 1/20 0.49
HSPE1 P61604 1/20 0.49
CYP1B1 Q16678 1/20 0.49
SERPINE1 P05121 1/20 0.49

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
Anisaldehyde SCHEMBL20357563 0.93 ALDH1A1 (0.83) ALDH1A1CYP2A6CA4TRPA1LTA4H
Anisaldehyde SCHEMBL6814373 0.93 ALDH1A1 (0.83) ALDH1A1CYP2A6CA4TRPA1LTA4H
Mequinol SCHEMBL7191826 0.86 ALDH1A1 (0.64) ALDH1A1CYP2A6TRPA1LTA4HNPC1
Benzaldehyde SCHEMBL28430047 0.85 ALDH1A1 (0.78) ALDH1A1CYP2A6TRPA1TTRKMT2A
Biphenyl SCHEMBL10800283 0.85 ALDH1A1 (0.76) ALDH1A1CYP2A6CA4TRPA1LTA4H
Benzaldehyde SCHEMBL638106 0.85 ALDH1A1 (0.57) ALDH1A1CYP2A6TRPA1TTRNPC1
Anisaldehyde SCHEMBL5807087 0.85 ALDH1A1 (0.68) ALDH1A1CYP2A6TRPA1LTA4HNPC1
Benzaldehyde SCHEMBL9561919 0.85 ALDH1A1 (0.62) ALDH1A1CYP2A6TRPA1NPC1RAB9A
Anisaldehyde SCHEMBL27594108 0.84 CYP2A6 (0.73) ALDH1A1CYP2A6CA4TRPA1LTA4H
Anisaldehyde SCHEMBL717471 0.83 ALDH1A1 (1.00) ALDH1A1CYP2A6TRPA1TTRNFE2L2

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
CN-116635717-A Method for optically transparentizing tissue samples using embedding medium 摩比空公司 2023-08-22 CN claimed
CN-116635717-A Method for optically transparentizing tissue samples using embedding medium 摩比空公司 2023-08-22 CN disclosed
CN-116635717-A Method for optically transparentizing tissue samples using embedding medium 摩比空公司 2023-08-22 CN disclosed
EP-1954796-A1 IMPROVEMENTS RELATING TO FABRIC TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2008-08-13 EP disclosed
WO-2007062833-A1 IMPROVEMENTS RELATING TO FABRIC TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2007-06-07 WO disclosed