SCHEMBL9844722

SCHEMBL9844722

CC1c2cc3ccccc3n2CC1CC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.46
CCR3 P51677 1/20 0.45
BCHE P06276 2/20 0.45
DRD2 P14416 3/20 0.43
DRD4 P21917 3/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CXCR4 P61073 1/20 0.41

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
SCHEMBL9258751 0.89 ACHE (0.48) ACHECCR3
SCHEMBL9262802 0.76 ACHE (0.49) ACHEBCHEDRD2DRD4
SCHEMBL27347756 0.74 CCR3 (0.44) ACHECCR3DRD2DRD4
SCHEMBL9264946 0.73 ACHE (0.48) ACHEBCHEDRD4KDM4E
SCHEMBL9261883 0.72 ACHE (0.49) ACHEBCHEDRD2DRD4
SCHEMBL9844725 0.69 CCR3 (0.54) ACHECCR3DRD2DRD4ALDH1A1
SCHEMBL8531462 0.67 KDM4E (0.48) ACHEBCHEDRD2DRD4ALDH1A1
SCHEMBL9264959 0.67 BCHE (0.48) ACHEBCHEDRD4KDM4E
SCHEMBL12813632 0.67 KDM1A (0.61) ACHECCR3BCHEDRD2ALDH1A1
SCHEMBL2735346 0.66 CCR3 (0.71) ACHECCR3DRD2DRD4ALDH1A1

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
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed