SCHEMBL1880686

SCHEMBL1880686

NC(=O)C(CC(=O)O)NCCCO

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.33
PTGS1 P23219 1/20 0.33
KCNH2 Q12809 1/20 0.33
ITGB3 P05106 3/20 0.32
ITGAV P06756 3/20 0.32
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CPB2 Q96IY4 1/20 0.31
GNPAT O15228 1/20 0.30
GABRR1 P24046 2/20 0.30

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
SCHEMBL8424379 1.00 CAMK2A (0.33) CAMK2APTGS1KCNH2ITGB3ITGAV
SCHEMBL28308288 0.94 GPR84 (0.34) CAMK2AGPR84FFAR1FFAR4CPB2
SCHEMBL8634866 0.93 GPR84 (0.38) CAMK2AGPR84FFAR1FFAR4
SCHEMBL5144359 0.88 GABRR1 (0.32) ITGB3ITGAVALDH1A1LMNAGABRR1
SCHEMBL4030392 0.88 GABRR1 (0.32) ITGB3ITGAVALDH1A1LMNAGABRR1
SCHEMBL4553554 0.88 GABRR1 (0.32) ITGB3ITGAVALDH1A1LMNAGABRR1
SCHEMBL1374080 0.86 ECE1 (0.36) PTGS1KCNH2
SCHEMBL1374076 0.86 ECE1 (0.36) PTGS1KCNH2
SCHEMBL2910202 0.84 CA2 (0.39) CAMK2ACPB2GNPAT
SCHEMBL2910205 0.84 CA2 (0.39) CAMK2ACPB2GNPAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011059779-A2 LIGAND-TARGETED MULTI- STEREOISOMER PEPTIDE POLYMER CONJUGATES AND USES THEREOF GONZALEZ LUCIA IRENE (US) 2011-05-19 WO claimed
US-20110104783-A1 STEREOISOMER PEPTIDES, LIGAND-TARGETED MULTI- STEREOISOMER PEPTIDE POLYMER CONJUGATES, AND USES THEREOF GONZALEZ LUCIA IRENE 2011-05-05 US claimed
US-9790286-B2 Stereoisomer peptides, their polymer conjugates, their encapsulation into nanoparticles, and uses thereof for the treatment of diseases caused by abnormal angiogenesis GONZALEZ LUCIA IRENE (US) 2017-10-17 US disclosed
US-20150050351-A1 STEREOISOMER PEPTIDES, THEIR POLYMER CONJUGATES, THEIR ENCAPSULATION INTO NANOPARTICLES, AND USES THEREOF FOR THE TREATMENT OF DISEASES CAUSED BY ABNORMAL ANGIOGENESIS. GONZALEZ LUCIA IRENE (US) 2015-02-19 US disclosed
US-8906355-B2 Synthetic stereoisomer peptides in the retro-inverso and inverso configuration, and with cyclic and linear structure, their polymer conjugates, their encapsulation in polymer particles, and uses thereof GONZALEZ LUCIA IRENE (US) 2014-12-09 US disclosed
US-8715986-B2 Stereoisomer peptides, ligand-targeted multi- stereoisomer peptide polymer conjugates, and uses thereof GONZALEZ LUCIA IRENE (US) 2014-05-06 US disclosed
US-20130156723-A1 SYNTHETIC STEREOISOMER PEPTIDES IN THE RETRO-INVERSO AND INVERSO CONFIGURATION, AND WITH CYCLIC AND LINEAR STRUCTURE, THEIR POLYMER CONJUGATES, THEIR ENCAPSULATION IN POLYMER PARTICLES, AND USES THEREOF GONZALEZ LUCIA IRENE (US) 2013-06-20 US disclosed
WO-2011059779-A2 LIGAND-TARGETED MULTI- STEREOISOMER PEPTIDE POLYMER CONJUGATES AND USES THEREOF GONZALEZ LUCIA IRENE (US) 2011-05-19 WO disclosed
US-20110104783-A1 STEREOISOMER PEPTIDES, LIGAND-TARGETED MULTI- STEREOISOMER PEPTIDE POLYMER CONJUGATES, AND USES THEREOF GONZALEZ LUCIA IRENE 2011-05-05 US disclosed
EP-1487493-A4 CONJUGATES OF THERAPEUTIC OR CYTOTOXIC AGENTS AND BIOLOGICALLY ACTIVE PEPTIDES UNIV TULANE (US) 2006-08-30 EP disclosed
EP-1487493-A2 CONJUGATES OF THERAPEUTIC OR CYTOTOXIC AGENTS AND BIOLOGICALLY ACTIVE PEPTIDES The Administrators of The Tulane Educational Fund (US) 2004-12-22 EP disclosed
WO-2003074551-A2 CONJUGATES OF THERAPEUTIC OR CYTOTOXIC AGENTS AND BIOLOGICALLY ACTIVE PEPTIDES THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2003-09-12 WO disclosed