SCHEMBL8109675

SCHEMBL8109675

CNCCc1ccc2c(c1)sc(=O)n2C

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.56
HTR1A P08908 6/20 0.54
HTR2C P28335 4/20 0.54
MAPT P10636 1/20 0.49
ADRA2A P08913 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
HRH1 P35367 1/20 0.47

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
Hydrochloric Acid SCHEMBL8870607 0.99 SIGMAR1 (0.55) SIGMAR1HTR1AHTR2CMAPTADRA2A
SCHEMBL8109676 0.90 SIGMAR1 (0.59) SIGMAR1HTR1AHTR2CMAPT
Hydrochloric Acid SCHEMBL8871359 0.89 SIGMAR1 (0.58) SIGMAR1HTR1AHTR2C
SCHEMBL9659159 0.85 SIGMAR1 (0.53) SIGMAR1HTR1AHTR2CMAPTADRA2A
SCHEMBL9437721 0.85 SIGMAR1 (0.53) SIGMAR1HTR1AHTR2CMAPTADRA2A
Hydrochloric Acid SCHEMBL9437885 0.83 SIGMAR1 (0.52) SIGMAR1HTR1AHTR2CMAPTADRA2A
SCHEMBL9685737 0.83 SIGMAR1 (0.64) SIGMAR1HTR1AHTR2CADRA2AADRA2B
SCHEMBL8114236 0.82 SIGMAR1 (0.59) SIGMAR1HTR1AHTR2CADRA2AADRA2B
SCHEMBL7761420 0.82 SIGMAR1 (0.59) SIGMAR1HTR1AHTR2CADRA2AADRA2B
Hydrochloric Acid SCHEMBL8871795 0.81 SIGMAR1 (0.57) SIGMAR1HTR1AHTR2CADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673933-B1 Aminoalkyl benzoxazolinones and benzothiazolinones process for their preparation and compositions containing them ADIR (FR) 2000-11-08 EP disclosed
CN-1055924-C Novel aminoalkyl benzoxazolinones and benzothiazolinones process for their preparation and the pharmaceutical compositions which contain them ADIR (FR) 2000-08-30 CN disclosed
US-5688820-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS ADIR ET COMPAGNIE (FR) 1997-11-18 US disclosed
US-5688811-A PSYCHOLOGICAL DISORDERS; NERVOUS SYSTEM DISORDERS ADIR ET COMPAGNIE (FR) 1997-11-18 US disclosed
US-5534511-A AFFINITY FOR SIGMA RECEPTORS, ANTIINFLAMMATORY, TREATMENT OF ARTHRITIS ADIR ET COMPAGNIE (FR) 1996-07-09 US disclosed
CN-1112114-A Novel aminoalkyl benzoxazolinones and benzothiazolinones process for their preparation and the pharmaceutical compositions which contain them ADIR (FR) 1995-11-22 CN disclosed
EP-0673933-A1 Aminoalkyl benzoxazolinones and benzothiazolinones process for their preparation and compositions containing them ADIR ET COMPAGNIE (FR) 1995-09-27 EP disclosed
US-5296477-A Antidepressants ADIR ET COMPAGNIE (FR) 1994-03-22 US disclosed
US-5268381-A Antidepressant or anxiolytic compound ADIR ET COMPAGNIE (FR) 1993-12-07 US disclosed
US-5196434-A Antidepressants, anxiolytic agents ADIR ET COMPAGNIE (FR) 1993-03-23 US disclosed
EP-0478446-A1 Heterocyclic alkylamines, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-04-01 EP disclosed