SCHEMBL7311112

SCHEMBL7311112

CCOC(=O)CCNC(=O)C(Cc1ccc(-c2ccccc2)cc1)NCP(=O)(OC(OC(=O)CC)C(C)C)OC(OC(=O)CC)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
MMEL1 Q495T6 1/20 0.40
NOD2 Q9HC29 1/20 0.37
EED O75530 1/20 0.36
KLKB1 P03952 1/20 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
SCHEMBL7316899 0.95 CYP3A4 (0.42) L3MBTL1MMEL1
SCHEMBL7318799 0.94 L3MBTL1 (0.41) L3MBTL1MMEL1NOD2EED
SCHEMBL7307856 0.93 HRH4 (0.42) L3MBTL1MMEL1
SCHEMBL7317726 0.93 L3MBTL1 (0.40) L3MBTL1MMEL1
SCHEMBL7320312 0.92 L3MBTL1 (0.39) L3MBTL1MMEL1NOD2
SCHEMBL7311908 0.92 MMEL1 (0.48) L3MBTL1MMEL1
SCHEMBL7312621 0.92 MMEL1 (0.48) L3MBTL1MMEL1
SCHEMBL7309787 0.91 GPR142 (0.38) L3MBTL1NOD2EEDKLKB1
SCHEMBL7321253 0.91 L3MBTL1 (0.39) L3MBTL1MMEL1
SCHEMBL7319953 0.90 L3MBTL1 (0.39) L3MBTL1MMEL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0511940-A2 Phosphono/biaryl substituted dipeptide derivatives CIBA-GEIGY AG (CH) 1992-11-04 EP claimed
EP-0592367-A2 Phosphono/biaryl substituted dipeptide derivatives CIBA-GEIGY AG (CH) 1994-04-13 EP disclosed
US-5294632-A Diuretics and vasorelaxants CIBA-GEIGY CORPORATION (US) 1994-03-15 US disclosed
EP-0511940-A2 Phosphono/biaryl substituted dipeptide derivatives CIBA-GEIGY AG (CH) 1992-11-04 EP disclosed
US-5155100-A Treating cardiovascular disorders in mammals CIBA-GEIGY CORPORATION (US) 1992-10-13 US disclosed