Taiwaniaquinol E

Taiwaniaquinol E

SCHEMBL31237185

COc1c(O)c2c(c(O)c1C(C)C)C(=O)[C@H]1C(C)(C)CCC[C@]21C

nearest known ligand 0.37

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 3/20 0.37
▸ EP300 Q09472 1/20 0.36
▸ FDPS P14324 5/20 0.33
▸ CYP3A4 P08684 4/20 0.33
▸ TP53 P04637 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ GGPS1 O95749 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ CYP19A1 P11511 2/20 0.33
▸ CETP P11597 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PTGES O14684 1/20 0.30
▸ PNLIP P16233 1/20 0.30

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
Taiwaniaquinol B SCHEMBL31237215 1.00 USP2 (0.37) USP2EP300FDPSCYP3A4TP53
Taiwaniaquinol B SCHEMBL18105238 1.00 USP2 (0.37) USP2EP300FDPSCYP3A4TP53
SCHEMBL20089279 0.84 USP2 (0.39) USP2EP300FDPSCYP3A4TP53
SCHEMBL21291508 0.79 EP300 (0.40) USP2EP300FDPSCYP3A4TP53
SCHEMBL22861906 0.79 EP300 (0.40) USP2EP300FDPSCYP3A4TP53
SCHEMBL21291523 0.79 EP300 (0.40) USP2EP300FDPSCYP3A4TP53
SCHEMBL22862032 0.79 EP300 (0.40) USP2EP300FDPSCYP3A4TP53
SCHEMBL29497740 0.78 FDPS (0.36) EP300FDPSGGPS1
Orthosiphonol SCHEMBL29532734 0.72 FDPS (0.42) USP2FDPSCYP3A4TP53MAPT
Taiwaniaquinol C SCHEMBL31237206 0.71 PIK3CA (0.33) USP2FDPSCYP3A4TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024189607-A1 METHODS AND BIOAVAILABLE HIGHLY PERMEABLE COMPOUNDS FOR DISEASES TREATMENT DIDENKO KIRILL (MX) 2024-09-19 — — WO disclosed
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