SCHEMBL8967671

SCHEMBL8967671

Fc1ccccc1NCCC12CCCN1CCC2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ICMT O60725 3/20 0.43
SCN5A Q14524 2/20 0.42
SCN9A Q15858 2/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.35
KCNH2 Q12809 1/20 0.35
DRD3 P35462 1/20 0.34
ALKBH5 Q6P6C2 2/20 0.34
FTO Q9C0B1 2/20 0.34
GAA P10253 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL8967641 0.82 SCN5A (0.42) SCN5ASCN9ALMNAFTOGAA
Hydrochloric Acid SCHEMBL10842012 0.80 ALDH1A1 (0.41) ICMTSCN5ASCN9AKMT2ALMNA
SCHEMBL8967649 0.80 CA12 (0.49) MEN1KMT2AALDH1A1KDM4EKCNH2
SCHEMBL8967733 0.79 KDM4E (0.43) SCN5ASCN9AMEN1KMT2ALMNA
SCHEMBL8967660 0.77 ALDH1A1 (0.41) MEN1KMT2AALDH1A1KDM4EKCNH2
Hydrochloric Acid SCHEMBL8968053 0.76 KAT2B (0.51) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL4932077 0.73 MEN1 (0.61) MEN1KMT2AALDH1A1KDM4EDRD3
SCHEMBL8967669 0.71 TSHR (0.41) MEN1KMT2ALMNAALDH1A1KDM4E
SCHEMBL8556050 0.71 CTSB (0.43) MEN1KMT2ALMNAALDH1A1KDM4E
SCHEMBL8967682 0.70 POLB (0.47) ICMTMEN1LMNAKCNH2

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