SCHEMBL4734255

SCHEMBL4734255

O=[N+]([O-])c1[c]ccc([N+](=O)[O-])c1.O=[N+]([O-])c1cc(I)c(O)c(I)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
HTT P42858 2/20 0.64
LMNA P02545 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.39
GALR3 O60755 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GPR35 Q9HC97 6/20 0.38
ALDH1A1 P00352 5/20 0.38
TSHR P16473 5/20 0.38
ALOX15 P16050 2/20 0.38
HPGD P15428 2/20 0.37
MAPK1 P28482 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TTR P02766 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL26325 0.83 TSHR (0.48) LMNASMN1; SMN2GPR35ALDH1A1TSHR
Water SCHEMBL28995322 0.82 TSHR (0.46) LMNASMN1; SMN2GPR35ALDH1A1TSHR
SCHEMBL205059 0.80 MEN1 (1.00) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL12095462 0.78 MEN1 (0.95) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL12933087 0.73 MEN1 (0.84) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL6257261 0.71 SNCA (0.33) MEN1KMT2AHTTLMNATSHR
SCHEMBL3044183 0.71 ALDH1A1 (0.44) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL10383515 0.71 TSHR (0.46) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL887743 0.71 TSHR (0.48) MEN1KMT2AHTTLMNASMN1; SMN2
Edetic Acid SCHEMBL28237466 0.70 KCNH2 (0.41) MEN1KMT2AHTTLMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105837661-A Melanocortin receptor ligands 益普生制药股份有限公司 2016-08-10 CN disclosed
CN-103316345-B The application of melanocortin treatment insulin sensitivity IPSEN PHARMA S.A.S. (FR) 2016-05-18 CN disclosed
CN-103755786-B Melanocortin receptor ligands IPSEN PHARMA S. A. S. (FR) 2016-05-11 CN disclosed
CN-105111302-A Auxin gastrin-releasing peptide analogue SOD CONSEILS RECH APPLIC 2015-12-02 CN disclosed
CN-101282738-B Ghrelin analogs IPSEN PHARMA S.A.S. (FR) 2015-09-16 CN disclosed
WO-2008067831-A2 USE OF GHRELIN, AN ANALOGUE THEREOF OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CHARITE UNIVERSITÄTSMEDIZIN - BERLIN (DE) 2008-06-12 WO disclosed
EP-1818061-A1 Use of ghrelin for stimulating hair growth Charite-Universitätsmedizin Berlin (DE) 2007-08-15 EP disclosed