SCHEMBL9511035

SCHEMBL9511035

C=CCCCCC1COC(c2ccc(-c3ccc(OCCCCCC)cc3)cc2)OC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.39
LMNA P02545 2/20 0.37
NR5A1 Q13285 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR1B P28222 1/20 0.36
HTR2B P41595 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC10A2 Q12908 1/20 0.35
LTA4H P09960 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ALDH2 P05091 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
TSHR P16473 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL9508643 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9511042 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9357587 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9507583 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9509767 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9511009 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9508661 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9357844 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9511021 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C
SCHEMBL9361890 1.00 RARB (0.39) RARBLMNANR5A1HTR2AHTR2C

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-0268198-B1 FERROELECTRIC LIQUID CRYSTALS F. HOFFMANN-LA ROCHE AG (CH) 1993-09-01 EP disclosed
US-5013476-A Ferroelectric properties, electro-optical indicating device HOFFMANN-LA ROCHE INC. (US) 1991-05-07 US disclosed