SCHEMBL7435344

SCHEMBL7435344

FC(F)(F)c1cccc(OC(CCN2CCN(c3ccccc3)CC2)c2ccc(Cl)s2)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 10/20 0.55
SIGMAR1 Q99720 2/20 0.47
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL7435077 0.87 LTA4H (0.47) HTR1AKDM4EALDH1A1LMNAGAA
SCHEMBL7443700 0.79 HTR1A (0.63) HTR1A
SCHEMBL7428297 0.77 HTR1A (0.53) HTR1A
SCHEMBL7442963 0.76 HTR1A (0.51) HTR1AKDM4EALDH1A1
SCHEMBL10053312 0.75 HTR1A (0.76) HTR1ASIGMAR1
SCHEMBL7427735 0.75 HTR1A (0.67) HTR1A
SCHEMBL10485755 0.74 MAPT (0.56) SIGMAR1KDM4EALDH1A1LMNAGAA
SCHEMBL10021769 0.74 HTR1A (0.80) HTR1ASIGMAR1
SCHEMBL350747 0.73 HTR1A (0.88) HTR1A
SCHEMBL10052737 0.73 HTR1A (0.80) HTR1A

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-0571685-A1 Aryloxyheteroarylpropylamines, their preparation and use NOVO NORDISK A/S (DK) 1993-12-01 EP disclosed