SCHEMBL620127

SCHEMBL620127

CCCCC(OC(CCCC)c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
CYP1A2 P05177 3/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 3/20 0.41
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RECQL P46063 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 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
SCHEMBL1123092 0.95 ALDH1A1 (0.46) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL8580651 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL28529420 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL139471 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
Tetradecane SCHEMBL9443244 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL17966113 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL3191410 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL8579304 0.94 ALDH1A1 (0.44) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL7564168 0.91 ALDH1A1 (0.49) ALDH1A1CYP1A2TSHRKMT2ALMNA
SCHEMBL6680574 0.81 ALDH1A1 (0.45) ALDH1A1CYP1A2TSHRKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110087758-B Selective extraction membrane for mining 巴斯夫欧洲公司 2022-06-03 CN claimed
CN-112138428-B Flat membrane type liquid phase micro-extraction method and application thereof in drug extraction 华中科技大学 2021-12-31 CN claimed
CN-112138428-A Flat membrane type liquid phase micro-extraction method and application thereof in drug extraction 华中科技大学 2020-12-29 CN claimed
WO-1998010852-A1 SUPPORTED LIQUID MEMBRANE SEPARATION COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 1998-03-19 WO claimed
WO-1998003860-A1 ION-SELECTIVE SENSOR Institut für Chemo- und Biosensorik Münster E.V. (DE) 1998-01-29 WO claimed
WO-1997040904-A1 SUPPORTED LIQUID MEMBRANE SEPARATION COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 1997-11-06 WO claimed
CN-110087758-B Selective extraction membrane for mining 巴斯夫欧洲公司 2022-06-03 CN disclosed
CN-112138428-B Flat membrane type liquid phase micro-extraction method and application thereof in drug extraction 华中科技大学 2021-12-31 CN disclosed
WO-2020260447-A1 IMPROVED FILM FOR SELECTIVE EXTRACTION OF METALS BASF SE (DE) 2020-12-30 WO disclosed
CN-112138428-A Flat membrane type liquid phase micro-extraction method and application thereof in drug extraction 华中科技大学 2020-12-29 CN disclosed
US-9120687-B2 Polymer inclusion membranes for use in processes for treating thiocyanate containing aqueous solutions THE UNIVERSITY OF MELBOURNE (AU) 2015-09-01 US disclosed
US-20140339154-A1 PROCESS FOR TREATING THIOCYANATE CONTAINING AQUEOUS SOLUTIONS KOLEV SPAS DIMITROV (AU) 2014-11-20 US disclosed
US-8829061-B2 Process for treating thiocyanate containing aqueous solutions THE UNIVERSITY OF MELBOURNE (AU) 2014-09-09 US disclosed
US-6174503-B1 NUCLEAR WASTES TREATMENT, ESPECIALLY WASTES WITH A HIGH CONCENTRATION OF COMPETING ALKALI METAL CATIONS LOCKHEED MARTIN ENERGY RESEARCH CORPORATION 2001-01-16 US disclosed
US-6096217-A Supported liquid membrane separation LOCKHEED MARTIN ENERGY RESEARCH CORPORATION (US) 2000-08-01 US disclosed
US-6086769-A Supported liquid membrane separation COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 2000-07-11 US disclosed
WO-1999012878-A1 SOLVENT AND PROCESS FOR EXTRACTING CESIUM FROM ALKALINE WASTE SOLUTIONS LOCKHEED MARTIN ENERGY RES COR (US) 1999-03-18 WO disclosed
WO-1998010852-A1 SUPPORTED LIQUID MEMBRANE SEPARATION COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 1998-03-19 WO disclosed
WO-1997040904-A1 SUPPORTED LIQUID MEMBRANE SEPARATION COMMODORE SEPARATION TECHNOLOGIES, INC. (US) 1997-11-06 WO disclosed
EP-0221508-A1 Sodium ion selective electrode HITACHI, LTD. (JP) 1987-05-13 EP disclosed