SCHEMBL8941763

SCHEMBL8941763

CC(C)(C)OC(=O)ON(CC=Cc1cccc(C2=NOC(c3ccc(F)cc3)C2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.46
PPARA Q07869 8/20 0.46
TSHR P16473 1/20 0.36
MIF P14174 1/20 0.35
S1PR1 P21453 3/20 0.35
KDM1A O60341 2/20 0.34
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 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
SCHEMBL8941743 0.79 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941448 0.79 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941453 0.79 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941553 0.78 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941556 0.78 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941421 0.77 PPARG (0.48) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941345 0.77 PPARG (0.50) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941338 0.77 PPARG (0.50) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941344 0.77 PPARG (0.50) PPARGPPARATSHRNPC1RAB9A
SCHEMBL8941431 0.70 PPARG (0.39) PPARGPPARATSHRMIFS1PR1

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-5552424-A Isoxazolines as antiinflammatory agents PFIZER INC. (US) 1996-09-03 US disclosed