SCHEMBL29367635

SCHEMBL29367635

CC(F)(F)c1cc(Br)c(F)cc1OCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.49
PKM P14618 1/20 0.49
CYP2C19 P33261 1/20 0.40
AAK1 Q2M2I8 1/20 0.39
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PPARD Q03181 1/20 0.36
AKR1B1 P15121 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
SCHEMBL29368471 0.86 PKM (0.47) PTGDR2PKMCYP2C19AAK1ALOX15
SCHEMBL5324019 0.81 PTGDR2 (0.57) PTGDR2PKMCYP2C19ALOX15TSHR
SCHEMBL22805275 0.76 ABCB11 (0.38) PTGDR2PKMCYP2C19AAK1TSHR
SCHEMBL22805273 0.76 ABCB11 (0.38) PTGDR2PKMCYP2C19AAK1TSHR
SCHEMBL22823754 0.76 AAK1 (0.36) PTGDR2AAK1
SCHEMBL29367638 0.76 AAK1 (0.36) PTGDR2AAK1
SCHEMBL28671829 0.76 AAK1 (0.36) PTGDR2AAK1
SCHEMBL4576631 0.75 PKM (0.65) PTGDR2PKMALOX15TSHRHSD17B10
SCHEMBL31324216 0.75 AAK1 (0.34) PTGDR2AAK1TSHRHSD17B10
SCHEMBL22823751 0.71 HMGCR (0.41) AAK1ALOX15HSD17B10PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4731200-A1 CLC-1 INHIBITORS FOR USE IN THE TREATMENT OF MULTIPLE SCLEROSIS AND NEUROMUSCULAR DISEASES NMD Pharma A/S (DK) 2026-04-29 EP claimed
CN-114008012-B Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2025-02-25 CN claimed
WO-2024261020-A1 CLC-1 INHIBITORS FOR USE IN THE TREATMENT OF MULTIPLE SCLEROSIS AND NEUROMUSCULAR DISEASES NMD PHARMA A/S (DK) 2024-12-26 WO claimed
CN-114008012-A Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2022-02-01 CN claimed
EP-4731200-A1 CLC-1 INHIBITORS FOR USE IN THE TREATMENT OF MULTIPLE SCLEROSIS AND NEUROMUSCULAR DISEASES NMD Pharma A/S (DK) 2026-04-29 EP disclosed
CN-114008012-B Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2025-02-25 CN disclosed
WO-2024261020-A1 CLC-1 INHIBITORS FOR USE IN THE TREATMENT OF MULTIPLE SCLEROSIS AND NEUROMUSCULAR DISEASES NMD PHARMA A/S (DK) 2024-12-26 WO disclosed
CN-114008012-A Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2022-02-01 CN disclosed