SCHEMBL7604029

SCHEMBL7604029

OCC1(CO)C=CN=C(c2ccccn2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.39
LMNA P02545 4/20 0.39
POLB P06746 2/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
CYP1A2 P05177 2/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
NPC1 O15118 5/20 0.36
RAB9A P51151 5/20 0.36
SORD Q00796 1/20 0.35
TP53 P04637 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 2/20 0.35

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
SCHEMBL21518187 0.86 KDM4E (0.38) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL5798402 0.84 KDM4E (0.36) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL28090842 0.84 KDM4E (0.36) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL31482990 0.81 KDM4E (0.34) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL28055751 0.81 KDM4E (0.42) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL31482987 0.80 KDM4E (0.33) KDM4ELMNAPOLBCCR1CCR5
Alcohol SCHEMBL29216994 0.80 KDM4E (0.35) KDM4ELMNAPOLBCCR1CCR5
Hydrochloric Acid SCHEMBL30022974 0.79 KDM4E (0.41) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL28452296 0.78 KDM4E (0.39) KDM4ELMNAPOLBCCR1CCR5
SCHEMBL435396 0.78 KDM4E (0.42) KDM4ELMNAPOLBCCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677972-A Tough type light-operated self-repairing lignin-based polyurethane and preparation method and application thereof 华南理工大学 2023-02-03 CN claimed
CN-115160460-A Grafted polyvinyl alcohol modified material and preparation method thereof 电子科技大学中山学院 2022-10-11 CN claimed
CN-105521784-B A kind of TiO2Anode surface load C o3O4Method 哈尔滨工业大学 2017-11-03 CN claimed
CN-105506666-B A kind of decomposition water device 哈尔滨工业大学 2017-08-25 CN claimed
CN-115078490-B Be used for detecting CN–Preparation method of iridium (III) complex sensitized NiO photocathode 青岛科技大学 2024-04-30 CN disclosed
CN-115160460-A Grafted polyvinyl alcohol modified material and preparation method thereof 电子科技大学中山学院 2022-10-11 CN disclosed
CN-115078490-A For detecting CN – Preparation method of iridium (III) complex sensitized NiO photocathode 青岛科技大学 2022-09-20 CN disclosed
CN-104685416-B Photosensitive polymer combination, using its cured film preparation method, cured film, liquid crystal display device and organic EL display device 富士胶片株式会社 2019-05-14 CN disclosed
CN-105521784-B A kind of TiO2Anode surface load C o3O4Method 哈尔滨工业大学 2017-11-03 CN disclosed
CN-105506666-B A kind of decomposition water device 哈尔滨工业大学 2017-08-25 CN disclosed
EP-0580979-B1 Method of detection by inducing electrochemiluminescence IGEN INT INC (US) 2002-12-18 EP disclosed
US-6140138-A RAPID, EFFICIENT, AND SENSITIVE DETECTION USING A CHEMICAL MOIETY WHICH IS A BIOLOGICAL MATERIAL ATTACHED TO A COMPOUND WHICH CAN BE ACTIVATED REPEATEDLY TO CHEMILUMINESCE IF EXPOSED TO ELECTROCHEMICAL ENERGY; REPORTER MOLECULES IGEN INTERNATIONAL INC. (US) 2000-10-31 US disclosed
US-5731147-A INDUCING CHEMICAL MOIETY TO ELECTROLUMINESCENCE WHICH IS DETECTED; DIAGNOSIS/MEDICAL IGEN INTERNATIONAL, INC. (US) 1998-03-24 US disclosed
US-5714089-A RUTHENIUM- OR OSMIUM-CONTAINING ORGANOMETALLIC COMPLEX; QUANTITATIVE ANALYSIS, MEDICAL DIAGNOSIS, SENSITIVITY, EFFICIENCY IGEN INTERNATIONAL, INC. (US) 1998-02-03 US disclosed
US-5310687-A Ruthenium and osmium compounds, analyzing biological materials IGEN, INC. (US) 1994-05-10 US disclosed
EP-0580979-A2 Luminescent metal chelate labels and means for detection IGEN, INC. (US) 1994-02-02 EP disclosed
US-5238808-A Biological substance attached to ruthenium or osmium complex IGEN, INC. (US) 1993-08-24 US disclosed
WO-1986002734-A1 LUMINESCENT METAL CHELATE LABELS AND MEANS FOR DETECTION HYPERION CATALYSIS INTERNATIONAL, INC. (US) 1986-05-09 WO disclosed