SCHEMBL29459155

SCHEMBL29459155

CCCCCCCCCC(O)Oc1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
RARB P10826 3/20 0.40
HRH3 Q9Y5N1 1/20 0.38
SLC2A1 P11166 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NR5A1 Q13285 1/20 0.37
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
BDKRB2 P30411 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GCGR P47871 1/20 0.35
HTT P42858 1/20 0.35
CTRC Q99895 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
SCHEMBL27360717 0.88 CYP1A2 (0.45) PPARGPPARARARBPTGESALOX5
SCHEMBL14185287 0.87 PPARG (0.38) PPARGPPARARARBHRH3MEN1
SCHEMBL9413733 0.86 ESR2 (0.43)
SCHEMBL5414686 0.86 NR5A1 (0.49) RARBNR5A1CYP3A4CYP2D6
SCHEMBL12808526 0.83 PPARG (0.38) PPARGPPARARARBHRH3SLC2A1
SCHEMBL29116694 0.82 TSHR (0.52) PPARGPPARARARBHRH3PTGES
SCHEMBL29116633 0.82 TSHR (0.52) PPARGPPARARARBHRH3PTGES
SCHEMBL29116693 0.82 TSHR (0.52) PPARGPPARARARBHRH3PTGES
SCHEMBL6250338 0.82 TSHR (0.52) PPARGPPARARARBHRH3PTGES
SCHEMBL6261663 0.82 RARB (0.63) RARBMEN1KMT2A

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-3953434-A1 LIQUID CRYSTAL COMPOUNDS Rolic Technologies AG (CH) 2022-02-16 EP disclosed