SCHEMBL7993329

SCHEMBL7993329

O=C1CS(=O)(=O)CN1CCCCN1CCN(c2nsc3ccccc23)CC1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.61
DRD2 P14416 2/20 0.61
HTR2A P28223 2/20 0.61
HTR7 P34969 2/20 0.61
HTR6 P50406 2/20 0.61

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
SCHEMBL7996576 0.82 HTR1A (0.59) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL7993985 0.81 HTR1A (0.64) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL8831844 0.81 HTR1A (0.64) HTR1ADRD2HTR2AHTR7HTR6
Hydrochloric Acid SCHEMBL7997035 0.80 HTR1A (0.62) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL7285152 0.77 HTR2A (0.67) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL10843227 0.77 HTR2A (0.67) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL30649298 0.77 HTR1A (0.70) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL9601759 0.77 HTR1A (0.70) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL792775 0.77 HTR1A (0.98) HTR1ADRD2HTR2AHTR7HTR6
SCHEMBL25335774 0.77 HTR2A (0.67) HTR1ADRD2HTR2AHTR7HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6284775-B1 PSYCHOLOGICAL DISORDERS AVENTIS PHARMACEUTICALS INC. 2001-09-04 US disclosed
US-5371087-A Antipsychotic, analgesics, anticonvulsant and anxiolytic agent HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-12-06 US disclosed
US-5229388-A 3-[4-(1-substituted-4-piperazinyl)butyl]-4-thiazolidinone and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-07-20 US disclosed