SCHEMBL29022111

SCHEMBL29022111

COc1c(F)c(F)c(F)c2sc(S)nc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL12320085 0.78
SCHEMBL28548428 0.66 ALDH1A1 (0.32)
SCHEMBL6514749 0.64 ALDH1A1 (0.47) HSD17B10
SCHEMBL2248337 0.64 HSD17B10 (0.46) HSD17B10
SCHEMBL182607 0.63 HSD17B10 (0.40) HSD17B10
SCHEMBL4951694 0.63 HSD17B10 (0.35) HSD17B10
SCHEMBL9860182 0.61 ALDH1A1 (0.33)
SCHEMBL27809543 0.61
SCHEMBL3763099 0.60 HSD17B10 (0.41) HSD17B10
SCHEMBL10531690 0.60 PDE3B (0.36)

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-116284207-A Fluorinated modified antibacterial peptide and preparation method and application thereof 广州工业智能研究院 2023-06-23 CN disclosed