SCHEMBL29459646

SCHEMBL29459646

COc1cc(C=O)c(OC)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
CYP19A1 P11511 1/20 0.53
ERN1 O75460 5/20 0.50
TUBB1 Q9H4B7 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP1A2 P05177 5/20 0.48
CYP1A1 P04798 4/20 0.48
CYP1B1 Q16678 4/20 0.48
KMT2A Q03164 1/20 0.47
PRKDC P78527 1/20 0.46
TRIM24 O15164 1/20 0.43
TYR P14679 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43

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
SCHEMBL1002582 1.00 ALDH1A1 (0.58) ALDH1A1CYP19A1ERN1TUBB1KDM4E
SCHEMBL10728453 0.87 ERN1 (0.53) ALDH1A1ERN1TUBB1KDM4ETSHR
SCHEMBL24994747 0.84 ALDH1A1 (0.50) ALDH1A1CYP19A1ERN1TUBB1KDM4E
SCHEMBL28849706 0.84 ALDH1A1 (0.50) ALDH1A1CYP19A1ERN1TUBB1KDM4E
SCHEMBL15119999 0.82 ALDH1A1 (0.66) ALDH1A1ERN1TUBB1KDM4ETSHR
SCHEMBL4945362 0.82 ALDH1A1 (0.60) ALDH1A1CYP19A1ERN1TUBB1KDM4E
SCHEMBL12311288 0.80 ERN1 (0.65) ALDH1A1ERN1KDM4ETSHRTDP1
SCHEMBL1119262 0.80 PRKDC (0.50) ALDH1A1ERN1TUBB1KDM4ETSHR
SCHEMBL26100046 0.80 ALDH1A1 (0.52) ALDH1A1ERN1TUBB1KDM4ETSHR
SCHEMBL13452129 0.80 ERN1 (0.65) ALDH1A1ERN1TUBB1KDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114746069-A Three-step multi-tone hair dyeing method 汉高股份有限及两合公司 2022-07-12 CN claimed
EP-4003286-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL Henkel AG & Co. KGaA (DE) 2022-06-01 EP claimed
CN-114173750-A Improving the stability of agents for treating keratin materials 汉高股份有限及两合公司 2022-03-11 CN claimed
CN-116830036-A Two-component system 西托斯股份公司 2023-09-29 CN disclosed
CN-116830040-A Photopolymerizable compositions 西托斯股份公司 2023-09-29 CN disclosed
CN-114746103-A Rapafucin derivative compounds and methods of use thereof 约翰霍普金斯大学 2022-07-12 CN disclosed
CN-114746069-A Three-step multi-tone hair dyeing method 汉高股份有限及两合公司 2022-07-12 CN disclosed
CN-114173750-A Improving the stability of agents for treating keratin materials 汉高股份有限及两合公司 2022-03-11 CN disclosed