SCHEMBL29989293

SCHEMBL29989293

C=Cc1ccc(C[n+]2ccc(-c3cc[n+](C)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.55
CHKA P35790 8/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
KDM4A O75164 2/20 0.39
KDM2A Q9Y2K7 2/20 0.39
SLC22A2 O15244 1/20 0.38
SLC22A1 O15245 1/20 0.38
SLC22A3 O75751 1/20 0.38
SLC6A4 P31645 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL12910774 0.91 CHKA (0.49) CHKAKDM4EALDH1A1RAB9ABCHE
SCHEMBL24038376 0.91 CHKA (0.49) CHKAKDM4EALDH1A1RAB9ABCHE
Hydrochloric Acid SCHEMBL25439458 0.90 CHKA (0.47) CHKAKDM4EALDH1A1RAB9ABCHE
Hydrochloric Acid SCHEMBL25439461 0.90 CHKA (0.47) CHKAKDM4EALDH1A1RAB9ABCHE
SCHEMBL12530148 0.87 KDM4E (0.58) CHKAKDM4EALDH1A1RAB9ABCHE
SCHEMBL30223671 0.87 HDAC8 (0.41) HDAC8CHKAKDM4EALDH1A1RAB9A
SCHEMBL13996861 0.85 ALDH1A1 (0.56) CHKAKDM4EALDH1A1RAB9ACA1
Hydrochloric Acid SCHEMBL30007947 0.83 ALDH1A1 (0.58) CHKAKDM4EALDH1A1RAB9ACA1
SCHEMBL31598838 0.82 ALDH1A1 (0.50) HDAC8CHKAALDH1A1BCHEACHE
SCHEMBL14002782 0.80 LPL (0.41) CHKAKDM4EALDH1A1RAB9ACA1

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-115746469-B Hydrogel and preparation method and application thereof 五邑大学 2025-06-03 CN claimed
CN-115414523-B Hydrogel dressing and preparation method thereof 五邑大学 2023-09-12 CN claimed
CN-115746469-A Hydrogel and preparation method and application thereof 五邑大学 2023-03-07 CN claimed
CN-115414523-A Hydrogel dressing and preparation method thereof 五邑大学 2022-12-02 CN claimed
CN-115746469-B Hydrogel and preparation method and application thereof 五邑大学 2025-06-03 CN disclosed
CN-115414523-B Hydrogel dressing and preparation method thereof 五邑大学 2023-09-12 CN disclosed
CN-115746469-A Hydrogel and preparation method and application thereof 五邑大学 2023-03-07 CN disclosed
CN-115414523-A Hydrogel dressing and preparation method thereof 五邑大学 2022-12-02 CN disclosed