SCHEMBL8968088

SCHEMBL8968088

ClCCC12CCCN1CCC2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.38
KCNH2 Q12809 1/20 0.33
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
HTR4 Q13639 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL10924907 0.80 KCNH2 (0.33) CHRNA7KCNH2
SCHEMBL8556163 0.79 CHRNA7 (0.36) CHRNA7KCNH2
SCHEMBL9561693 0.75 CHRNA7 (0.34) CHRNA7KCNH2
SCHEMBL23951881 0.71 MEN1 (0.37) SIGMAR1
SCHEMBL10842235 0.71 CHRNA7 (0.33) CHRNA7KCNH2
SCHEMBL5271990 0.71 MEN1 (0.37) SIGMAR1
SCHEMBL24637969 0.71 KCNH2 (0.32) KCNH2
SCHEMBL22969947 0.70 OPRM1 (0.30)
SCHEMBL12852095 0.70 OPRM1 (0.30)
SCHEMBL9562288 0.69 CHRNA7 (0.36) CHRNA7KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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