SCHEMBL150880

SCHEMBL150880

C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
LMNA P02545 1/20 0.42
AKR1B1 P15121 1/20 0.42
TYR P14679 1/20 0.40
NR1H3 Q13133 1/20 0.40
FUCA1 P04066 2/20 0.40
GAA P10253 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
XDH P47989 1/20 0.39
SLC29A1 Q99808 1/20 0.39
BCL9 O00512 1/20 0.38
CTNNB1 P35222 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
SCHEMBL14365700 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL9053183 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL2543592 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL15781205 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL15782553 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL4609138 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL2943984 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL2296345 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL7596584 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR
SCHEMBL4106150 1.00 CA12 (0.48) CA12CA9LMNAAKR1B1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6764832-B2 COMPOSITION FOR USE IN THE DETECTION OF SHIGELLA IN SAMPLE R&F PRODUCTS, INC. 2004-07-20 US claimed
US-20030049718-A1 Plating media for the presumptive identification of the genus Shigella and the species Shigella sonnei and shigella boydii R&F PRODUCTS, INC. 2003-03-13 US claimed
US-4874695-A COLORIMETRIC ANALYSIS AMERICAN HOME PRODUCTS CORP. (US) 1989-10-17 US claimed
EP-2951279-B1 METHOD AND CULTURE DEVICE FOR DETECTING YEASTS AND MOLDS 3M INNOVATIVE PROPERTIES CO (US) 2020-12-09 EP disclosed
US-10472662-B2 Compositions for the detection of intracellular bacterial targets and other intracellular microorganism targets BECTON, DICKINSON AND COMPANY (US) 2019-11-12 US disclosed
EP-3553163-A1 ARTICLE AND METHOD FOR DETECTING AEROBIC BACTERIA 3M Innovative Properties Company (US) 2019-10-16 EP disclosed
EP-3114209-B1 ARTICLE AND METHOD FOR DETECTING AEROBIC BACTERIA 3M INNOVATIVE PROPERTIES CO (US) 2019-06-12 EP disclosed
US-20180087084-A1 COMPOSITIONS FOR THE DETECTION OF INTRACELLULAR BACTERIAL TARGETS AND OTHER INTRACELLULAR MICROORGANISM TARGETS BECTON DICKINSON CO (US) 2018-03-29 US disclosed
EP-3031912-B1 THERMOSTABLE SS-XYLOSIDASE HONDA MOTOR CO LTD (JP) 2018-03-21 EP disclosed
US-9879214-B2 Method and culture device for detecting yeasts and molds 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-01-30 US disclosed
US-9834807-B2 Compositions for the detection of intracellular bacterial targets and other intracellular micororganism targets BECTON, DICKINSON AND COMPANY (US) 2017-12-05 US disclosed
US-20020025517-A1 METHODS AND COMPOSITIONS FOR CELLULAR AND METABOLIC ENGINEERING CODEXIS, INC. 2002-02-28 US disclosed
US-6309883-B1 EVOLUTION OF NEW METABOLIC PATHWAYS AND THE ENHANCEMENT OF BIOPROCESSING THROUGH RECURSIVE SEQUENCE RECOMBINATION WHICH ENTAILS PERFORMING INTERATIVE CYCLES OF RECOMBINATION AND SCREENING TO EVOLVE INDIVISUAL GENES, WHOLE PLASMIDS, VIRUSES MAXYGEN, INC. 2001-10-30 US disclosed
US-5962326-A FOR FOOD PROCESSING OF LOW LACTOSE-MILK AND CHEESE WHERE HEATING PREVENTS CONTAMINATION WITH MICROORGANISMS DURING PROCESSING AND ELEVATES THE SOLUBILITY OF LACTOSE WHICH SERVES AS A SUBSTRATE SHIMADA ATSUSHI (JP) 1999-10-05 US disclosed
US-5837458-A BIOCATALYTIC ACTIVITY OF CELLS WITH DNA SEGMENTS OF GENES TO PRODUCE LIBRARIES OF RECOMBINANT GENES AND SCREENING MAXYGEN, INC. (US) 1998-11-17 US disclosed
EP-0687732-B1 Hyperthermostable beta-galactosidase gene TAKARA SHUZO CO (JP) 1998-05-06 EP disclosed
US-5744345-A GENE DERIVED FROM PYROCOCCUS WITH DNA SEQUENCES TAKARA SHUZO CO., LTD. (JP) 1998-04-28 US disclosed
EP-0725144-A1 Process for the preparation of glycosides using glycosidases from ciliates HOECHST AKTIENGESELLSCHAFT (DE) 1996-08-07 EP disclosed
EP-0687732-A1 Hyperthermostable beta-galactosidase gene TAKARA SHUZO CO. LTD. (JP) 1995-12-20 EP disclosed
US-4874695-A COLORIMETRIC ANALYSIS AMERICAN HOME PRODUCTS CORP. (US) 1989-10-17 US disclosed