SCHEMBL7360752

SCHEMBL7360752

COc1ccc(CNC(=O)c2cc(C(F)(F)F)ccc2N[C@@H](C)CO)cc1C#N

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.49
PPARD Q03181 7/20 0.49
PPARG P37231 7/20 0.47
PSEN1 P49768 3/20 0.45
PSEN2 P49810 3/20 0.45
APH1B Q8WW43 3/20 0.45
NCSTN Q92542 3/20 0.45
APH1A Q96BI3 3/20 0.45
PSENEN Q9NZ42 3/20 0.45

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
SCHEMBL7360754 0.87 PPARA (0.49) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL7372290 0.86 PPARA (0.53) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL7361163 0.83 PPARA (0.54) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL7361602 0.80 PPARA (0.48) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6939346 0.80 APEX1 (0.47)
SCHEMBL6941972 0.80 APEX1 (0.47)
SCHEMBL6939351 0.80 APEX1 (0.47)
SCHEMBL7367034 0.78 PPARA (0.44) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6941879 0.78 PPARA (0.52) PPARAPPARDPPARGPSEN1PSEN2
SCHEMBL6943685 0.76 LMNA (0.45)

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