SCHEMBL7170240

SCHEMBL7170240

Fc1cccc2c1OC1CNCC1C2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.34
SLC6A2 P23975 4/20 0.34
CHRNB2 P17787 2/20 0.34
CHRNA4 P43681 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 1/20 0.34
CHRNA7 P36544 1/20 0.34
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
PRKAG3 Q9UGI9 1/20 0.33
PRKAG2 Q9UGJ0 1/20 0.33
PRKAB1 Q9Y478 1/20 0.33
HTR2C P28335 3/20 0.33
HTR1A P08908 2/20 0.31
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 0.31
HTR2A P28223 1/20 0.30
HTR2B P41595 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
SCHEMBL8383139 1.00 KCNH2 (0.34) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
Hydrochloric Acid SCHEMBL9480501 0.98 KCNH2 (0.34) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
Hydrochloric Acid SCHEMBL10766371 0.98 KCNH2 (0.34) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
Hydrochloric Acid SCHEMBL9480862 0.98 KCNH2 (0.34) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
SCHEMBL12184324 0.77 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PRKAB2PRKAG1
Hydrochloric Acid SCHEMBL2589524 0.76 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3PRKAB2PRKAG1
SCHEMBL10368468 0.75 CHRNB2 (0.40) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
SCHEMBL10368470 0.75 CHRNB2 (0.40) KCNH2SLC6A2CHRNB2CHRNA4SLC6A4
Hydrochloric Acid SCHEMBL10370902 0.74 CHRNB2 (0.39) SLC6A2CHRNB2CHRNA4SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL10370903 0.74 CHRNB2 (0.39) SLC6A2CHRNB2CHRNA4SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0460912-A2 Medicaments for the treatment of sexual disorder GLAXO GROUP LIMITED (GB) 1991-12-11 EP claimed
EP-0224332-B1 HETEROCYCLIC AMINO COMPOUNDS GLAXO GROUP LIMITED (GB) 1990-08-08 EP claimed
EP-0655914-B1 Use of Histamine-2 agonists for treatment of sexual dysfunction NAHOUM CESAR ROBERTO DIAS (BR) 2003-02-26 EP disclosed
EP-0655914-A4 NOVEL COMPOSITIONS. NAHOUM CESAR ROBERTO DIAS (BR) 1998-04-22 EP disclosed
EP-0655914-A1 NOVEL COMPOSITIONS NAHOUM, Cesar Roberto Dias (BR) 1995-06-07 EP disclosed
WO-1994004120-A2 METHODS OF TREATING SEXUAL DYSFUNCTION IN ANIMALS WITH AND H AGONIST NAHOUM CESAR ROBERTO DIAS (BR) 1994-03-03 WO disclosed
EP-0224332-A1 Heterocyclic amino compounds GLAXO GROUP LIMITED (GB) 1987-06-03 EP disclosed