SCHEMBL7320312

SCHEMBL7320312

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

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
MMEL1 Q495T6 1/20 0.39
NOD2 Q9HC29 1/20 0.38
MME P08473 1/20 0.37
ACE P12821 1/20 0.37

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
SCHEMBL7310277 0.95 CYP3A4 (0.42) L3MBTL1MMEL1NOD2MMEACE
SCHEMBL7314499 0.94 HRH4 (0.41) L3MBTL1MMEL1
SCHEMBL7311112 0.92 L3MBTL1 (0.40) L3MBTL1MMEL1NOD2
SCHEMBL7310006 0.92 MMEL1 (0.48) L3MBTL1MMEL1MMEACE
SCHEMBL7319612 0.92 MME (0.38) L3MBTL1NOD2MMEACE
SCHEMBL7314444 0.91 TLR2 (0.39) L3MBTL1
SCHEMBL9683565 0.91 L3MBTL1 (0.38) L3MBTL1MMEL1
SCHEMBL7311781 0.89 TLR2 (0.38)
Hydrochloric Acid SCHEMBL9683593 0.89 TLR2 (0.38)
SCHEMBL7316899 0.88 CYP3A4 (0.42) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-5155100-A Treating cardiovascular disorders in mammals CIBA-GEIGY CORPORATION (US) 1992-10-13 US disclosed