SCHEMBL7302389

SCHEMBL7302389

O=C[C@H]1NCC(=S)C1C(=O)[C@@H]1CCCN1C(=O)CCCC1=Cc2ccccc2C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 8/20 0.47
DPP4 P27487 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HTR1A P08908 1/20 0.33
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
DRD3 P35462 1/20 0.33
HTR2B P41595 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL9049670 0.97 PREP (0.47) PREPDPP4CHRM2CHRM4CHRM1
SCHEMBL9049709 0.97 PREP (0.46) PREPDPP4CHRM2CHRM4CHRM1
SCHEMBL9048664 0.95 PREP (0.48) PREPCHRM2CHRM4CHRM1CHRM3
SCHEMBL7442223 0.92 PREP (0.48) PREPCHRM2CHRM4CHRM1CHRM3
SCHEMBL7295277 0.91 PREP (0.59) PREPCHRM2CHRM4CHRM1CHRM3
SCHEMBL7434400 0.88 PREP (0.58) PREPCHRM2CHRM4CHRM1CHRM3
SCHEMBL9048703 0.84 PREP (0.41) PREP
SCHEMBL9046582 0.83 PREP (0.44) PREPDPP4CHRM2CHRM4CHRM1
SCHEMBL9046480 0.83 PREP (0.46) PREPCHRM2CHRM4CHRM1CHRM3
SCHEMBL9048411 0.83 PREP (0.46) PREPCHRM2CHRM4CHRM1CHRM3

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
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-0372484-B1 Condensed benzene derivative ZERIA PHARM CO LTD (JP) 1994-10-26 EP disclosed
EP-0536399-A1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-04-14 EP disclosed
US-5028604-A Cognition Activators ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-07-02 US disclosed
EP-0372484-A2 Condensed benzene derivative ZERIA PHARMACEUTICAL CO., LTD. (JP) 1990-06-13 EP disclosed