SCHEMBL9565859

SCHEMBL9565859

CCCCC/C=C\C/C=C\CCCCCCCC(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.75
CNR2 P34972 4/20 0.75
MAPT P10636 3/20 0.67
LMNA P02545 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
HTR1A P08908 2/20 0.58
HTR7 P34969 2/20 0.58
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
EPHX2 P34913 3/20 0.54
FAAH O00519 2/20 0.54
ALDH1A1 P00352 4/20 0.51
F7 P08709 3/20 0.51
F3 P13726 3/20 0.51
PPARG P37231 2/20 0.51
PPARD Q03181 2/20 0.51
PPARA Q07869 2/20 0.51
TSHR P16473 2/20 0.51
DUSP3 P51452 1/20 0.51

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
SCHEMBL9565863 1.00 CNR1 (0.75) CNR1CNR2MAPTLMNANPSR1
SCHEMBL13080421 0.90 MAPT (0.82) CNR1CNR2MAPTLMNANPSR1
SCHEMBL7696482 0.90 MAPT (0.82) CNR1CNR2MAPTLMNANPSR1
SCHEMBL9565881 0.90 MAPT (0.82) CNR1CNR2MAPTLMNANPSR1
SCHEMBL10726722 0.90 MAPT (0.82) CNR1CNR2MAPTLMNANPSR1
SCHEMBL7698031 0.90 MAPT (0.82) CNR1CNR2MAPTLMNANPSR1
SCHEMBL9565884 0.85 CNR1 (0.66) CNR1CNR2MAPTLMNANPSR1
SCHEMBL9565882 0.85 CNR1 (0.66) CNR1CNR2MAPTLMNANPSR1
SCHEMBL28528627 0.82 CNR1 (0.61) CNR1CNR2MAPTLMNAHTR1A
SCHEMBL28520169 0.82 CNR1 (0.61) CNR1CNR2MAPTLMNAHTR1A

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-0548798-A1 Antiviral agent SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-06-30 EP claimed
EP-0548798-A1 Antiviral agent SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-06-30 EP disclosed