SCHEMBL8967651

SCHEMBL8967651

CN(CC12CCCN1CCC2)c1ccc(Cl)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.44
CYP1A2 P05177 1/20 0.34
CYP2A6 P11509 1/20 0.34
OPRM1 P35372 5/20 0.33
HCN4 Q9Y3Q4 1/20 0.33
CHRNA7 P36544 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
KCNH2 Q12809 1/20 0.32
POLB P06746 1/20 0.32
OPRL1 P41146 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL8968081 0.84 CHEK1 (0.46) SIGMAR1OPRM1HRH3KCNH2OPRL1
SCHEMBL8967617 0.82 TUBB3 (0.38) SIGMAR1CYP1A2HCN4HRH3NPC1
SCHEMBL8968120 0.81 SLC6A3 (0.42) SIGMAR1CYP1A2HRH3KCNH2SLC6A2
SCHEMBL8554443 0.79 CTSB (0.43) SIGMAR1POLBNPSR1TDP1
SCHEMBL8967663 0.74 SIGMAR1 (0.47) SIGMAR1OPRM1KCNH2SLC6A2SLC6A4
SCHEMBL8967541 0.73 SIGMAR1 (0.37) SIGMAR1OPRM1KCNH2SLC6A2SLC6A4
SCHEMBL8967681 0.70 SIGMAR1 (0.40) SIGMAR1POLBRAB9A
SCHEMBL8967724 0.68 SIGMAR1 (0.38) SIGMAR1CYP1A2HRH3KCNH2SLC6A2
SCHEMBL8967505 0.67 SIGMAR1 (0.35) SIGMAR1OPRM1CHRNA7KCNH2SLC6A4
SCHEMBL8967652 0.67 SIGMAR1 (0.41) SIGMAR1CYP1A2OPRM1KCNH2TSHR

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
EP-0647642-A1 1-Azabicyclo(3.3.0)octane derivatives and their use SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1995-04-12 EP claimed
US-5530138-A A PYRROLIZINE DERIVATIVE; EFFECTIVE IN THE TREATMENT OF SENILE DEMENTIA SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1996-06-25 US disclosed
EP-0647642-A1 1-Azabicyclo(3.3.0)octane derivatives and their use SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1995-04-12 EP disclosed