SCHEMBL24967722

SCHEMBL24967722

Cc1cccc([C@@H]2CN(C(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.47
PPARA Q07869 4/20 0.47
FABP5 Q01469 3/20 0.44
FABP7 O15540 2/20 0.44
PDE4B Q07343 3/20 0.39
EPHX2 P34913 1/20 0.38
KMT2A Q03164 2/20 0.37
TLR2 O60603 1/20 0.37
TLR1 Q15399 1/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DPP4 P27487 1/20 0.36
TACR1 P25103 2/20 0.36

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
SCHEMBL24967824 0.89 FABP5 (0.51) PPARGPPARAFABP5FABP7PDE4B
SCHEMBL24967716 0.89 FABP5 (0.44) PPARGPPARAFABP5FABP7PDE4B
SCHEMBL24967723 0.88 FABP5 (0.44) PPARGPPARAFABP5FABP7PDE4B
SCHEMBL24967825 0.82 FABP5 (0.43) PPARGPPARAFABP5FABP7PDE4B
SCHEMBL24967724 0.82 FABP5 (0.44) PPARGPPARAFABP5FABP7PDE4B
SCHEMBL24967216 0.82 FABP5 (0.44) PPARGPPARAFABP5FABP7KMT2A
SCHEMBL24967215 0.82 FABP5 (0.44) PPARGPPARAFABP5FABP7KMT2A
SCHEMBL6978926 0.78 PDE4B (0.44) FABP5FABP7PDE4BEPHX2KMT2A
SCHEMBL6978922 0.78 PDE4B (0.44) FABP5FABP7PDE4BEPHX2KMT2A
SCHEMBL6978915 0.78 PDE4B (0.44) FABP5FABP7PDE4BEPHX2KMT2A

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
WO-2022192340-A9 SMALL MOLECULE ALLOSTERIC MODULATORS OF CLASS B GPCR, THE PTHR, AND METHOD TO IDENTIFY THEM UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-02-02 WO disclosed