SCHEMBL5304252

SCHEMBL5304252

CC(O)CCc1ccsc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.50
DRD2 P14416 2/20 0.46
DRD3 P35462 2/20 0.46
SLC1A3 P43003 2/20 0.39
SLC1A2 P43004 2/20 0.39
SLC1A1 P43005 2/20 0.39
TYR P14679 2/20 0.38
MME P08473 2/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
DPP4 P27487 1/20 0.37
ALDH1A1 P00352 2/20 0.35
ADORA2A P29274 1/20 0.35
LMNA P02545 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
MEN1 O00255 1/20 0.35
KDM4A O75164 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL4191800 0.83 TAAR1 (0.54) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL12594976 0.83 TAAR1 (0.54) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL27294335 0.80 TAAR1 (0.50) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL31223776 0.80 TAAR1 (0.55) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL5303749 0.80 TAAR1 (0.55) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL18579637 0.79
SCHEMBL1309996 0.79
SCHEMBL9071081 0.79
SCHEMBL8025772 0.78 DRD2 (0.49) TAAR1DRD2DRD3SLC1A3SLC1A2
SCHEMBL8025775 0.78 DRD2 (0.49) TAAR1DRD2DRD3SLC1A3SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109824814-B Vegetable oil/inorganic nanoparticle composite super-hydrophobic coating solution and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2021-02-19 CN claimed
CN-116254110-B Quantum dot microsphere for fluorescence immunochromatography and preparation method and application thereof 苏州星烁纳米科技有限公司 2024-05-24 CN disclosed
CN-116254110-A Quantum dot microsphere for fluorescence immunochromatography and preparation method and application thereof 苏州星烁纳米科技有限公司 2023-06-13 CN disclosed
CN-109824814-B Vegetable oil/inorganic nanoparticle composite super-hydrophobic coating solution and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2021-02-19 CN disclosed
CN-1923806-A Preparation method of optically active 4-phenylthio-2-butanol SHANGHAI JULONG PHARMACEUTICAL (CN) 2007-03-07 CN disclosed
WO-2007023281-A2 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2007-03-01 WO disclosed