SCHEMBL6130477

SCHEMBL6130477

O=C(O)C(Cc1ccccc1)NOCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.51
GPR132 Q9UNW8 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FPR2 P25090 1/20 0.49
NAALAD2 Q9Y3Q0 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CYP1A2 P05177 1/20 0.48
PPARG P37231 2/20 0.48
MMP2 P08253 3/20 0.48
MMP9 P14780 2/20 0.48

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
SCHEMBL6130478 1.00 MME (0.51) MMEGPR132NPSR1FPR2NAALAD2
SCHEMBL7211707 1.00 MME (0.51) MMEGPR132NPSR1FPR2NAALAD2
SCHEMBL29664067 0.94 MME (0.56) MMENAALAD2PPARG
SCHEMBL28216930 0.94 MME (0.56) MMENAALAD2PPARG
SCHEMBL11023405 0.89 PPARG (0.52) MMEGPR132FPR2PPARG
SCHEMBL8078091 0.87 ACE (0.56) MMEGPR132NPSR1
SCHEMBL5507068 0.86 NPC1 (0.49) MMEGPR132NPC1RAB9ACYP1A2
SCHEMBL9809609 0.86 MME (0.51) MMENPSR1FPR2NAALAD2CYP1A2
SCHEMBL7004556 0.86 NPC1 (0.49) MMEGPR132NPC1RAB9ACYP1A2
SCHEMBL9809605 0.86 MME (0.51) MMENPSR1FPR2NAALAD2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1417219-A4 LIBRARIES OF CONFORMATIONALLY CONSTRAINED PEPTIDES, CHIRAL AZACROWNS, AND PEPTIDOMIMETICS AND METHODS OF MAKING THE SAME METAPHORE PHARMACEUTICALS INC (US) 2005-05-25 EP disclosed
US-20040236519-A1 Libraries of confomationally constrained peptides, chiral azacrowns, and peptidomimetics and methods of making the same METAPHORE PHARMACEUTICALS, INC. 2004-11-25 US disclosed
EP-1417219-A2 LIBRARIES OF CONFORMATIONALLY CONSTRAINED PEPTIDES, CHIRAL AZACROWNS, AND PEPTIDOMIMETICS AND METHODS OF MAKING THE SAME Metaphore Pharmaceuticals Inc. (US) 2004-05-12 EP disclosed
WO-2002100883-A2 LIBRARIES OF CONFORMATIONALLY CONSTRAINED PEPTIDES, CHIRAL AZACROWNS, AND PEPTIDOMIMETICS AND METHODS OF MAKING THE SAME METAPHORE PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed
CN-1158568-A 2,3-dihydro-1-1(2,2,2-trifluoroethyl)-2-oxo-5-phenyl-1H-1,4-benzodiazepines MERCK & CO INC (US) 1997-09-03 CN disclosed
CN-1112125-A Acyloxyhexanoic acid derivatives CIBA GEIGY AG (CH) 1995-11-22 CN disclosed
US-4738803-A ENZYME INHIBITORS ROQUES BERNARD (FR) 1988-04-19 US disclosed
US-4618708-A ENKEPHALINASE INHIBITOR, ANALGESICS, ANTIDEPRESSANT, ANTIDIARRHEA, OR HYPOTENSIVE AGENT ROQUES BERNARD (FR) 1986-10-21 US disclosed
EP-0082088-B1 DERIVATIVES OF AMINO ACIDS AND THEIR THERAPEUTIC USE Roques, Bernard (FR) 1986-04-02 EP disclosed
EP-0082088-A1 Derivatives of amino acids and their therapeutic use Roques, Bernard (FR) 1983-06-22 EP disclosed