SCHEMBL28895602

SCHEMBL28895602

C=CCNCCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.55
SIRT1 Q96EB6 1/20 0.51

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
SCHEMBL11765817 0.90 OGA (0.53) ACHESIRT1
Hydrochloric Acid SCHEMBL31238051 0.86 TERT (0.50) SIRT1
SCHEMBL9218494 0.85 ACHE (0.66) ACHESIRT1
SCHEMBL9827604 0.83 ACHE (0.69) ACHESIRT1
SCHEMBL7476248 0.82 SIRT1 (0.66) ACHESIRT1
SCHEMBL28369359 0.81 ACHE (0.57) ACHESIRT1
SCHEMBL21309370 0.79 ACHE (0.59) ACHESIRT1
SCHEMBL16573400 0.79 ACHE (0.59) ACHESIRT1
SCHEMBL571198 0.78 CASP3 (0.54)
SCHEMBL28430378 0.78 ACHE (0.57) ACHESIRT1

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
CN-111484502-A Artemisinin derivative and intermediate, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2020-08-04 CN disclosed