SCHEMBL9672002

SCHEMBL9672002

CN(C)CCCCc1ccc(C(=O)OCCN(C)C)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 1/20 0.63
GAA P10253 1/20 0.60
ALDH1A1 P00352 2/20 0.57
MAPT P10636 2/20 0.57
LMNA P02545 2/20 0.56
KCNH2 Q12809 2/20 0.56
SIGMAR1 Q99720 2/20 0.56
CYP1A2 P05177 1/20 0.56
MAOA P21397 1/20 0.56
CNR1 P21554 1/20 0.56
DRD4 P21917 1/20 0.56
ACHE P22303 1/20 0.56
HRH2 P25021 1/20 0.56
HTR2A P28223 1/20 0.56
HTR2C P28335 1/20 0.56
MAPK1 P28482 1/20 0.56
NTSR1 P30989 1/20 0.56
HRH1 P35367 1/20 0.56
DRD3 P35462 1/20 0.56
SCN1A P35498 1/20 0.56

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
Iodomethane SCHEMBL9670336 0.97 PHLPP2 (0.60) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL7749439 0.88 ALDH1A1 (0.56) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL8963488 0.85 PHLPP2 (0.83) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL9725219 0.83 CYP4A11 (0.67) GAAALDH1A1MAPTKCNH2SIGMAR1
SCHEMBL16795164 0.83 PHLPP2 (0.69) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL9629064 0.82 GAA (0.84) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL11767896 0.81 PHLPP2 (0.67) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL30226598 0.81 PHLPP2 (0.67) PHLPP2GAAALDH1A1MAPTLMNA
SCHEMBL19285921 0.80 LMNA (0.57) PHLPP2GAAALDH1A1MAPTLMNA
Hydrochloric Acid SCHEMBL11772112 0.80 PHLPP2 (0.65) PHLPP2GAAALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5093370-A Useful prior to insertion of tracheotomy tube or discission TOBISHI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1992-03-03 US disclosed