SCHEMBL23677771

SCHEMBL23677771

COc1c(C=N)cn(S(=O)(=O)c2cccc(F)c2)c1-c1ccc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HTR6 P50406 12/20 0.37
▸ DRD2 P14416 1/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTR2C P28335 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PTGDR Q13258 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ ELAVL1 Q15717 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
SCHEMBL30963578 0.91 MEN1 (0.40) MEN1GFERKMT2AHTR6DRD2
SCHEMBL19385625 0.91 MEN1 (0.40) MEN1GFERKMT2AHTR6DRD2
SCHEMBL28566174 0.81 HTR6 (0.41) MEN1GFERKMT2AHTR6DRD2
SCHEMBL23658928 0.81 HTR6 (0.42) MEN1GFERKMT2AHTR6DRD2
SCHEMBL31512541 0.80 HTR6 (0.39) MEN1GFERKMT2AHTR6DRD2
SCHEMBL30963571 0.80 MEN1 (0.42) MEN1GFERKMT2AHTR6DRD2
SCHEMBL19385605 0.80 MEN1 (0.42) MEN1GFERKMT2AHTR6DRD2
Abeprazan SCHEMBL29719476 0.80 HTR6 (0.39) MEN1GFERKMT2AHTR6DRD2
Abeprazan SCHEMBL29443418 0.80 HTR6 (0.39) MEN1GFERKMT2AHTR6DRD2
Abeprazan SCHEMBL18196939 0.80 HTR6 (0.39) MEN1GFERKMT2AHTR6DRD2

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
EP-3854784-A1 METHOD FOR PRODUCING 4-METHOXY PYRROLE DERIVATIVE Daewoong Pharmaceutical Co., Ltd. (KR) 2021-07-28 — — EP disclosed
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