SCHEMBL28655843

SCHEMBL28655843

O=C=Cc1c(O)cc(Br)cc1F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.31

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
SCHEMBL16268831 0.79 ERN1 (0.41) DGAT1
SCHEMBL30169735 0.79 ERN1 (0.41) DGAT1
SCHEMBL31117200 0.75 ESR1 (0.34)
SCHEMBL2050124 0.68 CYP3A4 (0.46) DGAT1
SCHEMBL28980373 0.67
SCHEMBL28356847 0.66 ERN1 (0.47)
SCHEMBL189947 0.66 CYP3A4 (0.38) DGAT1
SCHEMBL578367 0.66 ERN1 (0.37) DGAT1
SCHEMBL29375214 0.66 CYP3A4 (0.38) DGAT1
SCHEMBL16272974 0.65 DGAT1 (0.33) DGAT1

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-113645971-A Compound and use thereof 福宏治疗公司 2021-11-12 CN disclosed