SCHEMBL8153391

SCHEMBL8153391

O=C(C[C@H]1CCc2ccccc2C1)C1C(=S)CN[C@@H]1C(=O)C1CCN[C@@H]1C(O)=S

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PREP P48147 11/20 0.34
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
NPY1R P25929 1/20 0.32
NPY5R Q15761 1/20 0.32
DGAT1 O75907 1/20 0.32
HTR1A P08908 1/20 0.30
HTR1D P28221 1/20 0.30

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
SCHEMBL9175911 1.00 PREP (0.34) PREPADRA1DADRA1AADRA1BNPY1R
SCHEMBL7294072 0.94
SCHEMBL9047518 0.91 GBA1 (0.32) ADRA1DADRA1AADRA1B
SCHEMBL9050007 0.91 GBA1 (0.32) ADRA1DADRA1AADRA1B
SCHEMBL9051048 0.89 GBA1 (0.35)
SCHEMBL9047663 0.89 GBA1 (0.35)
SCHEMBL9049381 0.88 GBA1 (0.38)
SCHEMBL9048296 0.87 KMT2A (0.31)
SCHEMBL9050045 0.85 PREP (0.30) PREP
SCHEMBL9048597 0.84 FAAH (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017929-A Cholinesterase activator ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed
EP-0754454-A1 CHOLINESTERASE ACTIVATOR ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-01-22 EP disclosed
EP-0536399-B1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-01-24 EP disclosed
US-5407950-A Brain disorders, senile dementia ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-18 US disclosed
EP-0536399-A1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-04-14 EP disclosed