SCHEMBL22823745

SCHEMBL22823745

CCC(=O)c1cc(Br)c(F)cc1O[C@H](CO)CF

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.35
AAK1 Q2M2I8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL29602355 1.00 HMGCR (0.35) HMGCRAAK1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL28676314 1.00 HMGCR (0.35) HMGCRAAK1ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL29601942 0.87 PTGDR2 (0.33) AAK1
SCHEMBL22823753 0.87 PTGDR2 (0.33) AAK1
SCHEMBL22823744 0.85 HMGCR (0.30) HMGCR
SCHEMBL28678912 0.85 HMGCR (0.30) HMGCR
SCHEMBL29601805 0.85 HMGCR (0.30) HMGCR
SCHEMBL22823977 0.85 HMGCR (0.35) HMGCRALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL29602464 0.85 HMGCR (0.35) HMGCRALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL28678911 0.85 HMGCR (0.35) HMGCRALDH1A1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114008012-B Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2025-02-25 CN disclosed
EP-3986852-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD Pharma A/S (DK) 2022-04-27 EP disclosed
CN-114008012-A Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2022-02-01 CN disclosed
WO-2020254559-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2020-12-24 WO disclosed