SCHEMBL8699482

SCHEMBL8699482

CCNc1ccc(OCC=C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.52
PPARG P37231 13/20 0.52
PPARA Q07869 13/20 0.52
NPC1 O15118 2/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL12442803 0.80 PPARD (0.55) PPARDPPARGPPARA
SCHEMBL17017214 0.77 PPARD (0.50) PPARDPPARGPPARANPC1PKM
SCHEMBL17017237 0.76 NPC1 (0.51) PPARDPPARGPPARANPC1PKM
SCHEMBL17017257 0.76 PPARG (0.50) PPARDPPARGPPARANPC1PKM
SCHEMBL11305960 0.76 HTT (0.46) PPARDPPARANPC1RAB9ALMNA
SCHEMBL11309358 0.76 HTT (0.46) PPARDPPARANPC1RAB9ALMNA
SCHEMBL17017230 0.75 PPARG (0.46) PPARDPPARGPPARANPC1RAB9A
SCHEMBL17017238 0.75 NPC1 (0.48) PPARDPPARGPPARANPC1PKM
SCHEMBL11265234 0.75 HTT (0.48) PPARDPPARGPPARANPC1RAB9A
SCHEMBL11265236 0.75 HTT (0.48) PPARDPPARGPPARANPC1RAB9A

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
US-5773469-A Diaryl antimicrobial agents ORTHO PHARMACEUTICAL CORPORATION (US) 1998-06-30 US disclosed