SCHEMBL6284450

SCHEMBL6284450

[CH2]c1cccc([N+](=O)[O-])c1OC

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.52
ALDH1A1 P00352 3/20 0.52
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GPR35 Q9HC97 2/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.42
RECQL P46063 1/20 0.42
HSPB1 P04792 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
GAA P10253 1/20 0.39
S100A4 P26447 1/20 0.39

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
SCHEMBL358770 0.86 TDP1 (0.61) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL580273 0.83 ALDH1A1 (0.44) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL31119225 0.81 TDP1 (0.71) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL31119224 0.81 TDP1 (0.71) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL2088309 0.81 TDP1 (0.71) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL25161887 0.81 TDP1 (0.55) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL16953059 0.81 TDP1 (0.41) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL11426790 0.81 ALDH1A1 (0.50) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL4564308 0.79 TSHR (0.60) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2
SCHEMBL1755968 0.79 TDP1 (0.53) TDP1ALDH1A1L3MBTL1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873519-A4 HIV PROTEASE INHIBITORS SCRIPPS RESEARCH INST (US) 2005-04-27 EP claimed
JP-2000502332-A 2000-02-29 JP claimed
EP-0873519-A1 HIV PROTEASE INHIBITORS The Scripps Research Institute (US) 1998-10-28 EP claimed
WO-1997021100-A9 HIV PROTEASE INHIBITORS 1997-10-30 WO claimed
WO-1997021100-A1 HIV PROTEASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 1997-06-12 WO claimed
EP-0336132-A1 1-Phenylpropyl compounds Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1989-10-11 EP claimed
WO-1989008644-A1 NEW 1-PHENYLPROPYL COMPOUNDS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1989-09-21 WO claimed
EP-3438236-B1 CELL CULTURE CONTAINER, CELL CULTURE SYSTEM, CELL CULTURE KIT AND CELL CULTURE METHOD SONY GROUP CORP (JP) 2022-08-24 EP disclosed
CN-109070079-B Sample separation kit and sample separation device 索尼公司 2022-02-22 CN disclosed
US-11226291-B2 Biological substance analysis method, biological substance analyzer, and biological substance analysis system SONY CORPORATION (JP) 2022-01-18 US disclosed
US-11199541-B2 Method for analyzing cell, chip for cell analysis, reagent for cell analysis, kit for cell analysis, and apparatus for cell analysis SONY CORPORATION (JP) 2021-12-14 US disclosed
US-20210364410-A1 PARTICLE CONFIRMING METHOD, PARTICLE TRAPPING CHIP, AND PARTICLE ANALYZING SYSTEM SONY CORPORATION (JP) 2021-11-25 US disclosed
US-20210053017-A1 MICROPARTICLE-CONTAINING LIQUID DISPERSING DEVICE, MICROPARTICLE SEDIMENTATION SUPPRESSION METHOD, MICROPARTICLE SORTING OR MEASURING DEVICE, AND MICROPARTICLE SEDIMENTATION SUPPRESSION VIBRATOR SONY CORPORATION (JP) 2021-02-25 US disclosed
EP-0873519-A1 HIV PROTEASE INHIBITORS The Scripps Research Institute (US) 1998-10-28 EP disclosed
WO-1997021100-A9 HIV PROTEASE INHIBITORS 1997-10-30 WO disclosed
WO-1997021100-A1 HIV PROTEASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 1997-06-12 WO disclosed
EP-0336132-A1 1-Phenylpropyl compounds Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1989-10-11 EP disclosed
WO-1989008644-A1 NEW 1-PHENYLPROPYL COMPOUNDS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1989-09-21 WO disclosed
US-4605747-A FUNGICIDES; PLANT GROWTH REGULATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-08-12 US disclosed
US-4014874-A Process for the manufacture of 3-substituted thiomethyl-7-amino-2-cephem-4-carboxylic acid compound CIBA-GEIGY CORPORATION (US) 1977-03-29 US disclosed