SCHEMBL7362104

SCHEMBL7362104

CCOC(=O)CCNC(=O)C(Cc1ccc(C(F)(F)F)cc1)CP(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.53
EPHX2 P34913 9/20 0.53
PPARA Q07869 7/20 0.45
PPARD Q03181 3/20 0.40
MME P08473 1/20 0.40
ECE1 P42892 1/20 0.40
ADAMTS4 O75173 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP9 P14780 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
MMP14 P50281 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 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
SCHEMBL7369951 0.86 EPHX2 (0.49) PPARGEPHX2MMEECE1
SCHEMBL7316396 0.85 MME (0.53) PPARGEPHX2MMEECE1
SCHEMBL10790828 0.84 MME (0.52) PPARGEPHX2MMEECE1
SCHEMBL7398127 0.84 MME (0.51) PPARGEPHX2PPARAMMEECE1
SCHEMBL7365444 0.76 MME (0.50) PPARGEPHX2MMEECE1MMP1
SCHEMBL7365124 0.74 MME (0.48) PPARAMMEECE1
SCHEMBL16839663 0.73 EPHX2 (0.49) PPARGEPHX2PPARAPPARD
SCHEMBL10790277 0.72 MME (0.46) MMEECE1
SCHEMBL29666394 0.72 GCGR (0.50) PPARGEPHX2PPARA
SCHEMBL16839882 0.72 CYP4F2 (0.49) PPARGEPHX2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0117429-B1 PHOSPHOROUS CONTAINING COMPOUNDS AS INHIBITORS OF ENKEPHALINASES SCHERING CORPORATION (US) 1987-09-02 EP claimed
EP-0117429-A1 Phosphorous containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1984-09-05 EP claimed
EP-0117429-B1 PHOSPHOROUS CONTAINING COMPOUNDS AS INHIBITORS OF ENKEPHALINASES SCHERING CORPORATION (US) 1987-09-02 EP disclosed
EP-0117429-A1 Phosphorous containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1984-09-05 EP disclosed