SCHEMBL7124762

SCHEMBL7124762

CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(N)=O)C(C)C)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NMUR2 Q9GZQ4 4/20 0.52
NMUR1 Q9HB89 3/20 0.52
KDM1A O60341 2/20 0.52
KISS1R Q969F8 3/20 0.50
F2 P00734 4/20 0.50
NPY1R P25929 1/20 0.49
NPY2R P49146 1/20 0.49
NPY4R P50391 1/20 0.49
NPY5R Q15761 1/20 0.49
TFPI P10646 4/20 0.49

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
SCHEMBL8441486 0.96 KDM1A (0.54) NMUR2NMUR1KDM1AKISS1RF2
SCHEMBL7331095 0.91 TFPI (0.60) NMUR2NMUR1KDM1ANPY1RNPY2R
SCHEMBL10376833 0.90 NMUR2 (0.51) NMUR2NMUR1KDM1AKISS1RF2
SCHEMBL8441481 0.89 NMUR2 (0.52) NMUR2NMUR1KDM1AKISS1RNPY1R
SCHEMBL29394357 0.88 NPY1R (0.59) KDM1AF2NPY1RNPY2RNPY4R
SCHEMBL30586993 0.86 NTSR2 (0.57) F2NPY1RNPY2RNPY4RNPY5R
SCHEMBL8521204 0.85 SLC6A2 (0.56) NMUR2NMUR1NPY1RNPY2RNPY4R
SCHEMBL29539289 0.84 AGTR2 (0.58) NPY1RNPY2RNPY4RNPY5R
SCHEMBL25845490 0.84 SLC6A2 (0.55) KISS1RF2NPY1RNPY2RNPY4R
SCHEMBL7279684 0.84 NTSR1 (0.57) NPY1RNPY2RNPY4RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030044800-A1 Drug discovery employing calorimetric target triage ALTHEXIS COMPANY, INC., THE 2003-03-06 US disclosed
US-20020142046-A1 Protein particles for therapeutic and diagnostic use YEN, RICHARD C.K. 2002-10-03 US disclosed
US-6391343-B1 PARTICLE COMPRISING FIBRINOGEN BOUND ON SURFACE OF ALBUMIN MATRIX, CAPABLE OF CO-AGGREGATION WITH PLATELETS, AND OF AGGREGATION IN SOLUTION CONTAINING SOLUBLE FIBRINOGEN AT CONCENTRATION NOT CAPABLE OF CLOT FORMATION BY ITSELF HEMOSPHERE, INC. 2002-05-21 US disclosed
EP-1194767-A2 THERMO-CHEMICAL SENSORS AND USES THEREOF The Althexis Company, Inc. (US) 2002-04-10 EP disclosed
WO-2001006250-A2 THERMO-CHEMICAL SENSORS AND USES THEREOF THE ALTHEXIS COMPANY, INC. (US) 2001-01-25 WO disclosed
EP-0831793-A4 PROTEIN PARTICLES FOR THERAPEUTIC AND DIAGNOSTIC USE HEMOSPHERE INC (US) 2000-11-15 EP disclosed
US-5945033-A ALBUMIN, HEMOGLOBIN MIXTURE; STABILITY HEMOSPHERE, INC. (US) 1999-08-31 US disclosed
EP-0831793-A1 PROTEIN PARTICLES FOR THERAPEUTIC AND DIAGNOSTIC USE HEMOSPHERE, INC. (US) 1998-04-01 EP disclosed
US-5725804-A ALBUMIN PARTICLES STABLE TO RESOLUBILIZATION, POLYOXYETHYLENE GLYCOL, ALCOHOL HEMOSPHERE, INC. (US) 1998-03-10 US disclosed
US-5616311-A AQUEOUS ALBUMIN SUSPENSION STABILIZED BY HEMOGLOBIN PARTICLES HEMOSPHERE, INC. (US) 1997-04-01 US disclosed
WO-1996039128-A1 PROTEIN PARTICLES FOR THERAPEUTIC AND DIAGNOSTIC USE HEMOSPHERE, INC. (US) 1996-12-12 WO disclosed