SCHEMBL7367034

SCHEMBL7367034

COc1ccc(CNC(=O)c2cc(C(F)(F)F)ccc2NC2CCC(NC=O)CC2)cc1C#N

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.44
PPARG P37231 6/20 0.43
PSEN1 P49768 3/20 0.42
PSEN2 P49810 3/20 0.42
APH1B Q8WW43 3/20 0.42
NCSTN Q92542 3/20 0.42
APH1A Q96BI3 3/20 0.42
PSENEN Q9NZ42 3/20 0.42
PPARD Q03181 5/20 0.41
BTK Q06187 1/20 0.39
CCR2 P41597 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
SCHEMBL7365758 0.85 PPARA (0.42) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7365754 0.85 PPARA (0.42) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7361163 0.79 PPARA (0.54) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7404179 0.79 PDE5A (0.48)
SCHEMBL7360754 0.79 PPARA (0.49) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7368352 0.78 PDE5A (0.50) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7368350 0.78 PDE5A (0.50) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7367010 0.78 PDE5A (0.40)
SCHEMBL7360752 0.78 PPARA (0.49) PPARAPPARGPSEN1PSEN2APH1B
SCHEMBL7366356 0.77 FLT3 (0.44) PPARAPPARGPSEN1PSEN2APH1B

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-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed