SCHEMBL30963571

SCHEMBL30963571

COC(=O)c1cn(S(=O)(=O)c2cccc(F)c2)c(-c2ccc(F)cc2F)c1OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HTR6 P50406 5/20 0.40
▸ GFER P55789 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ ALPL P05186 1/20 0.37
▸ DRD2 P14416 1/20 0.37
▸ PTGDR Q13258 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL19385605 1.00 MEN1 (0.42) MEN1KMT2AHTR6GFERALDH1A1
SCHEMBL31512541 0.90 HTR6 (0.39) MEN1KMT2AHTR6GFERALDH1A1
SCHEMBL20530219 0.89 MEN1 (0.42) MEN1KMT2AHTR6GFERALDH1A1
SCHEMBL23677756 0.88 HTR6 (0.42) MEN1KMT2AHTR6GFERALDH1A1
SCHEMBL31019969 0.88 POLB (0.44) MEN1KMT2AALPLTSHR
SCHEMBL25188299 0.88 POLB (0.44) MEN1KMT2AALPLTSHR
SCHEMBL23658928 0.84 HTR6 (0.42) MEN1KMT2AHTR6GFERDRD2
SCHEMBL28996387 0.84 PTGS2 (0.38) MEN1KMT2AALDH1A1ALPLPTGDR
SCHEMBL30287367 0.84 PTGS2 (0.38) MEN1KMT2AALDH1A1ALPLPTGDR
SCHEMBL28996384 0.84 KMT2A (0.38) MEN1KMT2AALDH1A1ALPLSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504552-A Potassium ion competitive retarder intermediate and preparation method thereof 菏泽皓元医药科技有限公司 2025-02-25 — — CN disclosed
CN-112739684-B Process for the preparation of 4-methoxypyrrole derivatives 株式会社大熊制药 2024-06-04 — — CN disclosed
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