SCHEMBL9863233

SCHEMBL9863233

C=CCc1cc(C2=NCCO2)ccc1OCCCCCc1cc(C)no1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.39
CNR1 P21554 1/20 0.37
GABRA1 P14867 5/20 0.36
GABRB2 P47870 5/20 0.36
SCARB1 Q8WTV0 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
MAPK1 P28482 1/20 0.34
MAPT P10636 1/20 0.33
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
SLC2A1 P11166 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.32
NR1I2 O75469 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALOX5 P09917 1/20 0.32

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
SCHEMBL9862912 0.90 SCARB1 (0.36) SCARB1MAPTKCNH2HRH3MEN1
SCHEMBL9862920 0.90 SCARB1 (0.35) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9862855 0.90 SCARB1 (0.35) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9667787 0.87 SCARB1 (0.39) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9705703 0.87 SCARB1 (0.39) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9862982 0.86 SCARB1 (0.35) SCARB1MAPTKCNH2HRH3MEN1
SCHEMBL9862905 0.86 SCARB1 (0.35) SCARB1MAPTKCNH2HRH3MEN1
SCHEMBL9863182 0.85 SCARB1 (0.36) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9862948 0.85 SCARB1 (0.36) SCARB1MAPTKCNH2HRH3MEN1
SCHEMBL9667970 0.85 DRD2 (0.39) SCARB1L3MBTL1MAPTKCNH2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5002960-A Viricides for combating picornaviruses STERLING DRUG, INC. (US) 1991-03-26 US disclosed
US-4939267-A Viricides STERLING DRUG INC. (US) 1990-07-03 US disclosed
US-4843087-A OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES STERLING DRUG INC. (US) 1989-06-27 US disclosed