SCHEMBL8967641

SCHEMBL8967641

Clc1ccccc1NCCC12CCCN1CCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.42
SCN9A Q15858 2/20 0.42
CHRNA7 P36544 1/20 0.38
SIGMAR1 Q99720 2/20 0.38
HCN4 Q9Y3Q4 1/20 0.38
HPGD P15428 1/20 0.38
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
HTR3A P46098 1/20 0.37
HTR4 Q13639 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37
LMNA P02545 2/20 0.36
FTO Q9C0B1 1/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
EBP Q15125 1/20 0.36
GBA1 P04062 1/20 0.36
EPHB3 P54753 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL8967671 0.82 ICMT (0.43) SCN5ASCN9ALMNAFTOGAA
SCHEMBL8967649 0.80 CA12 (0.49) HPGDMAPTGAA
SCHEMBL8967733 0.79 KDM4E (0.43) SCN5ASCN9AHPGDLMNAMAPT
Hydrochloric Acid SCHEMBL10842012 0.77 ALDH1A1 (0.41) SCN5ASCN9ACHRNA7SIGMAR1LMNA
SCHEMBL8967660 0.77 ALDH1A1 (0.41) CHRNA7HCN4HPGDHTR3EHTR3B
Hydrochloric Acid SCHEMBL8968053 0.76 KAT2B (0.51) LMNAMAPTGAAIDO1
SCHEMBL5770043 0.73 DRD3 (0.59) SIGMAR1HPGDLMNAMAPTGAA
SCHEMBL8967669 0.71 TSHR (0.41) HPGDLMNAMAPTGAA
SCHEMBL9421891 0.71 MAPT (0.52) SIGMAR1HPGDLMNAMAPTEBP
SCHEMBL8556050 0.71 CTSB (0.43) LMNAMAPT

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 4 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 claimed
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