SCHEMBL8066677

SCHEMBL8066677

CCN(CC)C(c1ccccc1)N(F)Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CNR2 P34972 1/20 0.39
LMNA P02545 1/20 0.39
OPRD1 P41143 1/20 0.37
AOC3 Q16853 1/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
ADRA1A P35348 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KCNH2 Q12809 2/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD1 P21728 1/20 0.37
OPRM1 P35372 1/20 0.37
DRD3 P35462 1/20 0.37
BCHE P06276 1/20 0.37

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
SCHEMBL516288 0.79 SIGMAR1 (0.45) ALDH1A1LMNAOPRD1AOC3SLC6A2
SCHEMBL18626285 0.73 BCHE (0.49) TSHRALDH1A1CNR2LMNAOPRD1
SCHEMBL14529989 0.71 TSHR (0.44) TSHRALDH1A1KDM4ECNR2LMNA
SCHEMBL19174197 0.71 TSHR (0.50) TSHRALDH1A1KDM4EAOC3SLC6A2
Hydrochloric Acid SCHEMBL27675308 0.70 TSHR (0.48) TSHRALDH1A1KDM4ELMNAAOC3
SCHEMBL12124877 0.70 TSHR (0.50) TSHRALDH1A1CNR2LMNAOPRD1
SCHEMBL19173952 0.69 TSHR (0.54) TSHRALDH1A1KDM4ECNR2LMNA
SCHEMBL21776637 0.68 SLC6A2 (0.48) TSHRALDH1A1KDM4EAOC3SLC6A2
SCHEMBL12126189 0.68 TSHR (0.48) TSHRALDH1A1KDM4ECNR2LMNA
SCHEMBL19046875 0.68 BCHE (0.51) TSHRALDH1A1KDM4ECNR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727316-B1 Printable document comprising means for revealing forgery AHLSTROM IND SA (FR) 2000-06-14 EP disclosed
EP-0727316-A1 Printable document comprising means for revealing forgery SIBILLE DALLE (FR) 1996-08-21 EP disclosed