SCHEMBL7361602

SCHEMBL7361602

COc1ccc(CNC(=O)c2cc(C(F)(F)F)ccc2N(CO)CCO)cc1C#N

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.48
PPARG P37231 6/20 0.48
PPARD Q03181 6/20 0.44
PSEN1 P49768 3/20 0.43
PSEN2 P49810 3/20 0.43
APH1B Q8WW43 3/20 0.43
NCSTN Q92542 3/20 0.43
APH1A Q96BI3 3/20 0.43
PSENEN Q9NZ42 3/20 0.43
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7360990 0.88 MEN1 (0.39) LMNA
SCHEMBL7361163 0.82 PPARA (0.54) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7360752 0.80 PPARA (0.49) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7364879 0.80 PPARA (0.47) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7366901 0.79 MCHR1 (0.39) LMNA
SCHEMBL7367480 0.79 PPARA (0.47) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7362850 0.77 PPARA (0.44) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7360754 0.77 PPARA (0.49) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL7368682 0.73 TSHR (0.45) LMNASMN1; SMN2
SCHEMBL7367034 0.73 PPARA (0.44) PPARAPPARGPPARDPSEN1PSEN2

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