SCHEMBL7320387

SCHEMBL7320387

CCCCCCCC(=O)O[C@@H](OP(=O)(O)CNC(Cc1ccc(-c2ccccc2)cc1)C(=O)NCCC(=O)O)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMEL1 Q495T6 1/20 0.44
TLR2 O60603 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
BCHE P06276 1/20 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
SCHEMBL7319307 1.00 MMEL1 (0.44) MMEL1TLR2L3MBTL1BCHE
SCHEMBL7314444 0.93 TLR2 (0.39) TLR2L3MBTL1BCHE
SCHEMBL7309636 0.92 TLR2 (0.41) TLR2L3MBTL1BCHE
SCHEMBL7310006 0.91 MMEL1 (0.48) MMEL1L3MBTL1
SCHEMBL7350142 0.88 MMEL1 (0.47) MMEL1L3MBTL1
SCHEMBL9683565 0.88 L3MBTL1 (0.38) MMEL1TLR2L3MBTL1BCHE
SCHEMBL7321253 0.86 L3MBTL1 (0.39) MMEL1TLR2L3MBTL1BCHE
SCHEMBL7322726 0.85 TLR2 (0.40) MMEL1TLR2L3MBTL1BCHE
SCHEMBL7310277 0.84 CYP3A4 (0.42) MMEL1L3MBTL1
SCHEMBL7320312 0.84 L3MBTL1 (0.39) MMEL1L3MBTL1

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