SCHEMBL2898235

SCHEMBL2898235

CC(C)[C@]1(C(N)=O)C(=O)CCC(=O)N1C(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 6/20 0.46
PSMB9 P28065 6/20 0.46
PSMB5 P28074 6/20 0.46
PSMB10 P40306 4/20 0.46
PSMB2 P49721 3/20 0.46
PSMB8 P28062 5/20 0.42
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
CPA1 P15085 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
OPRD1 P41143 3/20 0.39
PPARG P37231 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LNPEP Q9UIQ6 3/20 0.38

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
SCHEMBL2906422 0.87 OPRD1 (0.44) PSMB8MMEACECPA1ACE2
SCHEMBL2901655 0.84 OPRD1 (0.44) PSMB8MMEACECPA1ACE2
SCHEMBL2906563 0.81 OPRD1 (0.41) PSMB8MMEACECPA1ACE2
SCHEMBL2901690 0.76 OPRD1 (0.42) PSMB8MMEACECPA1ACE2
SCHEMBL2906899 0.76 OPRD1 (0.45) MMEACECPA1ACE2OPRD1
SCHEMBL11760152 0.72 LNPEP (0.59) PSMB1PSMB9PSMB5PSMB10PSMB2
SCHEMBL29839243 0.71 LTA4H (0.55) MMEOPRD1
SCHEMBL11598821 0.68 CTSC (0.52) PPARGLNPEP
SCHEMBL11670615 0.68 ERAP2 (0.61) PSMB1PSMB9PSMB5PSMB10PSMB2
SCHEMBL30631019 0.68 PSMB1 (0.61) PSMB1PSMB9PSMB5PSMB10PSMB2

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-2239270-A2 Low molecular weight peptide derivatives as inhibitors of the Laminin/Nidogen interaction Sanofi-Aventis Deutschland GmbH (DE) 2010-10-13 EP disclosed
EP-1845106-B1 Low molecular weight peptide derivatives as inhibitors of the laminin/nidogen interaction SANOFI AVENTIS DEUTSCHLAND (DE) 2010-08-11 EP disclosed
EP-1845106-A1 Low molecular weight peptide derivatives as inhibitors of the laminin/nidogen interaction Sanofi-Aventis Deutschland GmbH (DE) 2007-10-17 EP disclosed
EP-1157040-B1 LOW MOLECULAR WEIGHT PEPTIDE DERIVATIVES AS INHIBITORS OF THE LAMININ/NIDOGEN INTERACTION SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-22 EP disclosed
US-6365572-B1 FOR THERAPY OF DISEASES RELATED TO INCREASED OR UNWANTED SYNTHESIS OF BASEMENT MEMBRANES SUCH AS DIABETES MELLITUS; ATHEROSCLEROSIS; CANCER; DIABETIC RETINOPATHIA; FIBROPLASIA RETROLENTALIS; OR PSORIASIS, RHEUMATOIC ARTHRITIS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-02 US disclosed