SCHEMBL5487629

SCHEMBL5487629

COCCOCCN1CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
SCN9A Q15858 1/20 0.39
HSD11B1 P28845 1/20 0.39
HTT P42858 1/20 0.38
HTR1A P08908 1/20 0.38
HTR7 P34969 1/20 0.37
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL20231539 0.98 KDM4E (0.42) KDM4EALDH1A1SMN1; SMN2SCN9AHSD11B1
SCHEMBL22778298 0.93 ALDH1A1 (0.51) KDM4EALDH1A1SCN9A
SCHEMBL13559781 0.93 ALDH1A1 (0.51) KDM4EALDH1A1SCN9A
SCHEMBL502016 0.91 HRH3 (0.48) KDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL2680332 0.91 HRH3 (0.48) KDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL501715 0.91 HRH3 (0.48) KDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL27372825 0.89 HRH3 (0.40) KDM4EALDH1A1SMN1; SMN2SCN9A
SCHEMBL15362676 0.89 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2SCN9AHSD11B1
SCHEMBL720901 0.89 HRH3 (0.52) KDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL501546 0.89 HRH3 (0.52) KDM4EALDH1A1SMN1; SMN2HTT

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
EP-1835557-A2 Conductive polyamine-based electrolyte THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2007-09-19 EP disclosed
US-7238451-B2 Crosslinking polyethylenimine THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2007-07-03 US disclosed
EP-1393394-B1 CONDUCTIVE POLYAMINE-BASED ELECTROLYTE UNIV OKLAHOMA (US) 2006-11-22 EP disclosed
US-20020160271-A1 Conductive polyamine-based electrolyte THE BOARD OF REAGENTS OF THE UNIVERSITY OF OKLAHOMA 2002-10-31 US disclosed