SCHEMBL8967635

SCHEMBL8967635

CN(CC12CCCN1CCC2)c1ccc(F)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.43
SLC6A3 Q01959 4/20 0.43
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SIGMAR1 Q99720 5/20 0.35
OPRM1 P35372 4/20 0.35
KCNH2 Q12809 3/20 0.35
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
HRH3 Q9Y5N1 2/20 0.33
OPRL1 P41146 1/20 0.32
KRAS P01116 1/20 0.32
KDM1A O60341 1/20 0.31
CHRNA7 P36544 1/20 0.31
SLC6A2 P23975 1/20 0.31
KDM4E B2RXH2 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 0.85 CHEK1 (0.46) SIGMAR1OPRM1KCNH2HRH3OPRL1
SCHEMBL8967651 0.85 SIGMAR1 (0.44) SLC6A4SLC6A3SIGMAR1OPRM1KCNH2
SCHEMBL8967617 0.83 TUBB3 (0.38) MEN1KMT2ASIGMAR1ALDH1A1HRH3
SCHEMBL8968120 0.82 SLC6A3 (0.42) SLC6A4SLC6A3SIGMAR1KCNH2ALDH1A1
SCHEMBL8967505 0.81 SIGMAR1 (0.35) SLC6A4SLC6A3MEN1KMT2ASIGMAR1
SCHEMBL8554443 0.80 CTSB (0.43) MEN1KMT2ASIGMAR1ALDH1A1KDM4E
SCHEMBL8967663 0.75 SIGMAR1 (0.47) SLC6A4SLC6A3MEN1KMT2ASIGMAR1
SCHEMBL8967541 0.74 SIGMAR1 (0.37) SLC6A4SLC6A3SIGMAR1OPRM1KCNH2
SCHEMBL8967681 0.71 SIGMAR1 (0.40) KMT2ASIGMAR1ALDH1A1
SCHEMBL8967724 0.69 SIGMAR1 (0.38) SLC6A4SLC6A3SIGMAR1KCNH2ALDH1A1

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