SCHEMBL30143360

SCHEMBL30143360

CCCCCCCCCC1(CC(N)=O)OCCO1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
FAAH O00519 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
SOAT1 P35610 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8948233 0.84 GPR84 (0.41) MEN1KMT2A
SCHEMBL13124953 0.84 GPR84 (0.41) MEN1KMT2A
SCHEMBL4353419 0.84 GPR84 (0.41) MEN1KMT2A
SCHEMBL24812030 0.84 GRIN2D (0.36) MEN1KMT2A
SCHEMBL13124944 0.82 AKR1B1 (0.39) MEN1KMT2A
SCHEMBL25428919 0.81 ALDH1A1 (0.39) TP53
SCHEMBL14169233 0.80 POLB (0.38)
SCHEMBL14777833 0.79 TSHR (0.40)
SCHEMBL14779749 0.79 TSHR (0.40)
SCHEMBL14779365 0.79 TSHR (0.40)

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-115209891-A Analogs of N-acyl-homoserine lactones and pharmaceutical compositions containing the same 索邦大学 2022-10-18 CN disclosed