SCHEMBL7022643

SCHEMBL7022643

NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.53
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ITGB2 P05107 2/20 0.42
ICAM1 P05362 2/20 0.42
ITGAL P20701 2/20 0.42
CA2 P00918 6/20 0.40
CA1 P00915 4/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
SLC15A2 Q16348 1/20 0.40
CA4 P22748 1/20 0.39
GNPAT O15228 1/20 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
SCHEMBL5613494 1.00 ECE1 (0.53) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL618873 1.00 ECE1 (0.53) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL546997 1.00 ECE1 (0.53) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL30052291 0.93 ECE1 (0.50) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL7184807 0.93 ECE1 (0.50) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL16401 0.93 ECE1 (0.50) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL31707359 0.92 TGFBR1 (0.47) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL29591087 0.91 ECE1 (0.46) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL8087169 0.91 ECE1 (0.46) ECE1MEN1KMT2AITGB2ICAM1
SCHEMBL700301 0.91 ECE1 (0.46) ECE1MEN1KMT2AITGB2ICAM1

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
WO-2001070980-A9 ISOLATED G-PROTEIN COUPLED RECEPTORS, NUCLEIC ACID MOLECULES ENCODING GPCR PROTEINS, AND USES THEREOF AS INSECTICIDAL TARGETS PE CORP NY (US) 2003-01-16 WO claimed
CN-114057861-B bio-PROTAC artificial protein targeting UBE2C 深圳湾实验室坪山生物医药研发转化中心 2023-11-21 CN disclosed
CN-114341359-A Abiotic stress tolerant plants and methods thereof 未名生物农业集团有限公司 2022-04-12 CN disclosed
CN-114057861-A Bio-PROTAC artificial protein targeting UBE2C 深圳湾实验室坪山生物医药研发转化中心 2022-02-18 CN disclosed
CN-103491979-B Malaria vaccine based on pre-erythrocytic antigens from Plasmodium falciparum 马尔瓦有限责任公司 2016-12-21 CN disclosed
WO-2001070980-A2 ISOLATED G-PROTEIN COUPLED RECEPTORS, NUCLEIC ACID MOLECULES ENCODING GPCR PROTEINS, AND USES THEREOF AS INSECTICIDAL TARGETS PE CORPORATION (NY) (US) 2001-09-27 WO disclosed
EP-0763060-A4 PLANT GENES FOR SENSITIVITY TO ETHYLENE AND PATHOGENS UNIV PENNSYLVANIA (US) 1998-06-17 EP disclosed
WO-1998018927-A1 CANDIDA ALBICANS PROTEINS ASSOCIATED WITH VIRULENCE AND HYPHAL FORMATION AND USES THEREOF NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1998-05-07 WO disclosed
EP-0763060-A1 PLANT GENES FOR SENSITIVITY TO ETHYLENE AND PATHOGENS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1997-03-19 EP disclosed
WO-1995035318-A1 PLANT GENES FOR SENSITIVITY TO ETHYLENE AND PATHOGENS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1995-12-28 WO disclosed