SCHEMBL5664768

SCHEMBL5664768

O=C[C@H](Oc1ccccc1[N+](=O)[O-])[C@@H](O)[C@@H](O)[C@H](O)CO

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
NPC1 O15118 2/20 0.43
RECQL P46063 1/20 0.43
ALDH1A1 P00352 6/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 3/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.38
HPGD P15428 3/20 0.38
KCNH2 Q12809 1/20 0.37
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL20242766 1.00 RAB9A (0.43) RAB9ANPC1RECQLALDH1A1TDP1
SCHEMBL8124050 0.96 RAB9A (0.44) RAB9ANPC1RECQLALDH1A1TDP1
SCHEMBL10937320 0.89 GPR35 (0.38) RAB9ANPC1RECQLALDH1A1TDP1
SCHEMBL8520275 0.79 ALDH1A1 (0.33) RECQLALDH1A1TDP1L3MBTL1LMNA
SCHEMBL8346779 0.79 ALDH1A1 (0.33) RECQLALDH1A1TDP1L3MBTL1LMNA
SCHEMBL7755252 0.79 EPHX1 (0.32) TDP1L3MBTL1KMT2AMEN1KDM4E
SCHEMBL7744026 0.79 ALDH1A1 (0.33) RECQLALDH1A1TDP1L3MBTL1LMNA
SCHEMBL707743 0.76 MEN1 (0.42) RAB9ANPC1ALDH1A1TDP1KMT2A
SCHEMBL1582160 0.76 MEN1 (0.42) RAB9ANPC1ALDH1A1TDP1KMT2A
SCHEMBL8603750 0.76 MEN1 (0.42) RAB9ANPC1ALDH1A1TDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708922-B1 IDENTIFICATION OF LIGANDS BY SELECTIVE AMPLIFICATION OF CELLS TRANSFECTED WITH RECEPTORS ACADIA PHARM INC (US) 1999-03-10 EP claimed
JP-11315101-A None JP disclosed
JP-11315092-A None JP disclosed
US-20150293076-A1 Cellular Reprogramming for Product Optimization BOLT THREADS, INC. 2015-10-15 US disclosed
WO-2014066374-A1 CELLULAR REPROGRAMMING FOR PRODUCT OPTIMIZATION REFACTORED MATERIALS, INC. (US) 2014-05-01 WO disclosed
CN-102695955-A Assays for detecting anti-TNF drugs and autoantibodies PROMETHEUS LAB INC 2012-09-26 CN disclosed
CN-101180530-B Method of analyzing biochemical substance, analyzing reagent kit and analyzer HITACHI CHEMICAL CO LTD 2011-11-09 CN disclosed
CN-101180530-A Method of analyzing biochemical HITACHI CHEMICAL CO LTD (JP) 2008-05-14 CN disclosed
CN-101160525-A Genetic code increase of non-natural active amino acid SCRIPPS RESEARCH INST (US) 2008-04-09 CN disclosed
EP-1468098-A4 METHOD OF INHIBITING PATHOGENICITY OF INFECTIOUS AGENTS MASSACHUSETTS INST TECHNOLOGY (US) 2006-04-12 EP disclosed
US-5118611-A Useful for diagnostic, imaging treatment of cancer involving antibody binding interaction with marker ADEZA BIOMEDICAL CORPORATION (US) 1992-06-02 US disclosed
US-5096830-A Determination of fetal fibronectin presence in vaginal secretion ADEZA BIOMEDICAL CORPORATION (US) 1992-03-17 US disclosed
US-5079171-A Blood analysis, antibodies, competition or sandwich immunoassay ADEZA BIOMEDICAL CORPORATION (US) 1992-01-07 US disclosed
EP-0232816-B1 HETEROGENEOUS SPECIFIC BINDING ASSAY EMPLOYING AN AGGREGATABLE BINDING REAGENT MILES INC. (US) 1991-05-02 EP disclosed
EP-0387027-A2 Endometriosis diagnosis methods and reagents ADEZA BIOMEDICAL CORPORATION (US) 1990-09-12 EP disclosed
EP-0359274-A2 Pregnancy induced hypertension and eclampsia immunossay and reagents ADEZA BIOMEDICAL CORPORATION (US) 1990-03-21 EP disclosed
EP-0352722-A2 Adenocarcinoma antigen binding methods and reagents Smith, Lloyd H. (US) 1990-01-31 EP disclosed
EP-0316919-A2 Vaginal sample test and reagents ADEZA BIOMEDICAL CORPORATION (US) 1989-05-24 EP disclosed
US-4772550-A Heterogeneous specific binding assay employing an aggregatable binding reagent MILES INC. (US) 1988-09-20 US disclosed
US-4560648-A CONJUGATED THROUGH THIO GROUP OF B-GALACTOSIDASE SYNTEX (U.S.A.) INC. (US) 1985-12-24 US disclosed