SCHEMBL3229330

SCHEMBL3229330

CC(=O)N[C@@H]1[C@@H](OC(C)CN(C(=O)[C@@H](C)N)[C@H](CCC(=O)O)C(N)=O)[C@H](O)[C@@H](CO)O[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 1/20 0.57
MAPK1 P28482 2/20 0.54
ESR1 P03372 2/20 0.41
PGR P06401 2/20 0.41
HTR1A P08908 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
PTGS1 P23219 1/20 0.41
ADRA1A P35348 1/20 0.41
KCNH2 Q12809 1/20 0.41
ALDH1A1 P00352 2/20 0.39
THRB P10828 1/20 0.39
SELP P16109 5/20 0.37
LGALS3 P17931 1/20 0.31
MMP12 P39900 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAG P20916 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL5270133 1.00 NOD2 (0.57) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL342953 1.00 NOD2 (0.57) NOD2MAPK1ESR1PGRHTR1A
Water SCHEMBL769017 0.99 NOD2 (0.57) NOD2MAPK1ESR1PGRHTR1A
Alanine SCHEMBL11120060 0.98 NOD2 (0.56) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL4450131 0.94 NOD2 (0.55) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL4452390 0.94 NOD2 (0.55) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL10598564 0.94 MAPK1 (0.57) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL8203776 0.94 NOD2 (0.52) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL8539918 0.93 NOD2 (0.55) NOD2MAPK1ESR1PGRHTR1A
SCHEMBL4446205 0.93 NOD2 (0.55) NOD2MAPK1ESR1PGRHTR1A

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111317822-A Combined preparation containing flavone and immunoregulation peptide, preparation method and application thereof 中国科学院过程工程研究所 2020-06-23 CN claimed
WO-2010007250-A1 D,D-MURAMYL DIPEPTIDES, DERIVED COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF ATHEROMATOUS PLAQUES UNIVERSITE DE BOURGOGNE (FR) 2010-01-21 WO claimed
EP-0165123-B1 LIPOPHILE DERIVATIVES OF MURAMYL PEPTIDES HAVING MACROPHAGE-ACTIVATING PROPERTIES, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR OBTAINING THEM ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1990-08-08 EP claimed
US-4101649-A N-ACETYLMURAMYL-ALANYL-ISOGLUTAMINE AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1978-07-18 US claimed
CN-111317822-B Combined preparation containing flavone and immunoregulation peptide, preparation method and application thereof 中国科学院过程工程研究所 2022-03-08 CN disclosed
CN-111317822-A Combined preparation containing flavone and immunoregulation peptide, preparation method and application thereof 中国科学院过程工程研究所 2020-06-23 CN disclosed
WO-2010007250-A1 D,D-MURAMYL DIPEPTIDES, DERIVED COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF ATHEROMATOUS PLAQUES UNIVERSITE DE BOURGOGNE (FR) 2010-01-21 WO disclosed
WO-2010007250-A1 D,D-MURAMYL DIPEPTIDES, DERIVED COMPOUNDS AND USE THEREOF FOR THE TREATMENT OF ATHEROMATOUS PLAQUES UNIVERSITE DE BOURGOGNE (FR) 2010-01-21 WO disclosed
CN-1512890-A HCG formulation 开米卡公司 2004-07-14 CN 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-0831793-A4 PROTEIN PARTICLES FOR THERAPEUTIC AND DIAGNOSTIC USE HEMOSPHERE INC (US) 2000-11-15 EP disclosed
US-4939122-A Amplify tumoricidal properties AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1990-07-03 US disclosed
EP-0100734-B1 PROCESS FOR THE SEPARATION OR PURIFICATION OF A SLEEP PROMOTING FACTOR FROM A BIOLOGICAL SOURCE BY IMMUNOLOGICAL REACTION OF THE ANTIGEN-ANTIBODY KIND ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1986-12-17 EP disclosed
EP-0165123-A2 Lipophile derivatives of muramyl peptides having macrophage-activating properties, compositions containing them and processes for obtaining them ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1985-12-18 EP disclosed
US-4401659-A ANTI-INFECTIOUS AGENTS AGENCE NATIONAL DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1983-08-30 US disclosed
EP-0013651-B1 MURAMYL PEPTIDES FIXED ON PEPTIDE POLYMERS AND MEDICAMENTS CONTAINING THEM ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1983-06-15 EP disclosed
EP-0013651-A1 Muramyl peptides fixed on peptide polymers and medicaments containing them ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1980-07-23 EP disclosed
US-4101649-A N-ACETYLMURAMYL-ALANYL-ISOGLUTAMINE AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1978-07-18 US disclosed
US-4101649-A N-ACETYLMURAMYL-ALANYL-ISOGLUTAMINE AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1978-07-18 US disclosed