SCHEMBL9319232

SCHEMBL9319232

CCCCCOc1ccccc1N1CCNCC1

nearest known ligand 0.91

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.61
SLC6A2 P23975 4/20 0.61
SLC6A4 P31645 4/20 0.61
SLC6A3 Q01959 3/20 0.61
DRD2 P14416 3/20 0.60
DRD3 P35462 3/20 0.60
HTR3A P46098 3/20 0.60
HTR6 P50406 2/20 0.60
HTR3E A5X5Y0 1/20 0.60
HTR3B O95264 1/20 0.60
ADRB1 P08588 1/20 0.60
CYP2C19 P33261 1/20 0.60
HTR3D Q70Z44 1/20 0.60
HTR3C Q8WXA8 1/20 0.60
SIGMAR1 Q99720 1/20 0.60
LMNA P02545 1/20 0.59
MAPT P10636 1/20 0.59
HTR7 P34969 2/20 0.51

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
SCHEMBL8780407 0.99 HTR1A (0.59) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL9319475 0.95 HTR1A (0.62) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL6927912 0.91 HTR1A (0.64) HTR1ASLC6A2SLC6A4SLC6A3DRD2
Hydrochloric Acid SCHEMBL7302055 0.90 LMNA (0.65) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL27683904 0.85 DRD2 (0.61) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL7524534 0.84 HTR1A (0.68) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL255189 0.84 HTR1A (0.68) HTR1ASLC6A2SLC6A4SLC6A3DRD2
SCHEMBL7081828 0.84 HTR1A (0.59) HTR1ASLC6A2SLC6A4SLC6A3DRD2
Hydrochloric Acid SCHEMBL787250 0.83 MAPT (0.69) HTR1ASLC6A2SLC6A4SLC6A3DRD2
Hydrochloric Acid SCHEMBL16528267 0.83 MAPT (0.69) HTR1ASLC6A2SLC6A4SLC6A3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4210646-A ANTIFUNGAL, ANTIBACTERIAL JANSSEN PHARMACEUTICA N.V. (BE) 1980-07-01 US claimed
EP-0364350-B1 4-Methyl-5[2-(4-phenyl-1-piperazinyl)-ethyl] thiazole derivatives, their preparation and pharmaceutical compositions containing them INST RECH CHIM BIOLOG (FR) 1994-01-12 EP disclosed
US-5120736-A Treatment of functional dysuria associated with hyperactivity of adrenergic smypathetic nervous system INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (FR) 1992-06-09 US disclosed
WO-1990003972-A1 DERIVATIVES OF METAL-4 ((PHENYL-4 PIPERAZINYL-1)-2 ETHYL))-5 THIAZOLE INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (I.R.C.E.B.A.) (FR) 1990-04-19 WO disclosed
EP-0364350-A1 4-Methyl-5[2-(4-phenyl-1-piperazinyl)-ethyl] thiazole derivatives, their preparation and pharmaceutical compositions containing them INSTITUT DE RECHERCHES CHIMIQUES ET BIOLOGIQUES APPLIQUEES (IRCEBA) (FR) 1990-04-18 EP disclosed
US-4335126-A SEDATIVES, TRANQUILIZERS, AND ANTIPYRETICS; NEUROLEPTIC AND ANTIEDEMIC AGENTS DEGUSSA AKTIENGESELLSCHAFT (DE) 1982-06-15 US disclosed
US-4210646-A ANTIFUNGAL, ANTIBACTERIAL JANSSEN PHARMACEUTICA N.V. (BE) 1980-07-01 US disclosed
US-4210646-A ANTIFUNGAL, ANTIBACTERIAL JANSSEN PHARMACEUTICA N.V. (BE) 1980-07-01 US disclosed
US-4210646-A ANTIFUNGAL, ANTIBACTERIAL JANSSEN PHARMACEUTICA N.V. (BE) 1980-07-01 US disclosed